Other — Reversible iodine absorption of nonporous coordination polymer Cu(TCNQ)

8 measurement groups · 19 results

Reported values remain attached to the sample, method, conditions, extraction quality and source location that produced them.

reaction-time/composition observation from iodine absorption experiments

Cu(TCNQ)I4 from phase I by liquid-phase iodine absorption · Powder

comparison of solid-state and liquid-phase iodine absorption/desorption rates for phase I and phase II Cu(TCNQ)

Temperature: 285 for liquid-phase recipe where specified
Atmosphere: not explicitly stated
Geometry: powder reaction observation with XRD/TG confirmation
Context: pristine phase I/II transformed to iodine-loaded salts
Measurement source: p001-p003 / article pages 739-741 · Results · Fig. 2; Fig. 6

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
hexane desorption time to Cu(TCNQ)I	producing Cu(TCNQ)I in 40 days	960 h	—	Text Exact Reported	p002 / article page 740 · Results · Fig. 2
reaction outcome under air	reactions under air produced only heterogeneous mixtures containing hygroscopic materials	—	—	Text Qualitative	p004 / article page 742 · Experimental
liquid-phase phase II iodine loading after two months	n approximately 0.7 after two months	—	approximately	Text Approximate	p003 / article page 741 · Results
liquid-phase phase I time to Cu(TCNQ)I4	within two weeks	336 h	within	Text Approximate	p003 / article page 741 · Results · Fig. 6
solid-state grinding time to Cu(TCNQ)I4	within 30 min	0.5 h	within	Text Approximate	p001 / article page 739 · Results · Fig. 2

elemental analysis, Yanaco MT5 analyser

Bulk elemental and compositional analysis

Cu(TCNQ)I4 from phase I by liquid-phase iodine absorption · Powder

analysis of iodine-loaded product assigned as C12H4N4CuI4

Geometry: bulk elemental analysis
Context: iodine-loaded salt
Measurement source: p004 / article page 742 · Experimental

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
found carbon content for C12H4N4CuI4 product	C found 18.84% (calcd 18.54%)	—	calcd 18.54%	Text Exact Reported	p004 / article page 742 · Experimental
found hydrogen content for C12H4N4CuI4 product	H found 1.17% (calcd 0.52%)	—	calcd 0.52%	Text Exact Reported	p004 / article page 742 · Experimental
found nitrogen content for C12H4N4CuI4 product	N found 7.25% (calcd 7.23%)	—	calcd 7.23%	Text Exact Reported	p004 / article page 742 · Experimental

thermogravimetric analysis

Thermogravimetric analysis

Cu(TCNQ)I4 from phase I by liquid-phase iodine absorption · Powder

Cu(TCNQ)I4 prepared by liquid-phase reaction of phase I Cu(TCNQ)

Temperature: about 323-563
Atmosphere: nitrogen, based on Experimental TG method
Geometry: TG trace
Context: liquid-phase guest-loaded iodine salt
Measurement source: p003 / article page 741 · Iodine absorption by liquid-phase reaction · Fig. S5

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
first TG weight loss for liquid-phase Cu(TCNQ)I4	52.1% first large weight loss labelled in Fig. S5	—	—	Figure Axis Approximate	p002 · Supporting Information · Fig. S5
total TG weight loss for liquid-phase phase I-derived Cu(TCNQ)I4	65.9% total weight loss	—	—	Text Exact Reported	p003 / article page 741 · Results · Fig. S5

thermogravimetric analysis, Rigaku TG 8120, 1 K min-1

Thermogravimetric analysis

Cu(TCNQ)I4 from phase II by solid-state grinding · Powder

Cu(TCNQ)I4 prepared by solid-state reaction of phase II Cu(TCNQ); heating under nitrogen

Temperature: about 333-503
Atmosphere: nitrogen
Geometry: TG trace
Context: guest-loaded iodine salt
Measurement source: p002 / article page 740 · Results · Fig. S2

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
first TG weight loss for solid-state phase II-derived Cu(TCNQ)I4	59.0% first-step weight loss labelled in SI Fig. S2	—	calculated value labelled 58.9%	Figure Axis Approximate	p001 · Supporting Information · Fig. S2
total TG weight loss for solid-state phase II-derived Cu(TCNQ)I4	65.1% total weight loss	—	—	Text Exact Reported	p002 / article page 740 · Results · Fig. S2

thermogravimetric analysis, Rigaku TG 8120, 1 K min-1

Thermogravimetric analysis

Cu(TCNQ)I4 from phase I by solid-state grinding · Powder

Cu(TCNQ)I4 prepared by solid-state reaction of phase I Cu(TCNQ); heating under nitrogen

Temperature: 333-503
Atmosphere: nitrogen
Geometry: TG trace
Context: guest-loaded iodine salt
Measurement source: p002 / article page 740 · Results; Experimental · Fig. 4

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
first TG weight loss for solid-state phase I-derived Cu(TCNQ)I4	49.4% weight loss from 60-120 C, assigned to desorption of three iodine atoms	—	—	Text Exact Reported	p002 / article page 740 · Results · Fig. 4
second TG weight loss for solid-state phase I-derived Cu(TCNQ)I4	15.3% weight loss from 120-230 C, assigned to desorption of one iodine atom	—	—	Text Exact Reported	p002 / article page 740 · Results · Fig. 4
total TG weight loss for solid-state phase I-derived Cu(TCNQ)I4	64.7% total weight loss labelled in Fig. 4	—	calculated value labelled 65.5% in figure	Figure Axis Approximate	p002 / article page 740 · Results · Fig. 4

thermogravimetric analysis

Thermogravimetric analysis

Cu(TCNQ)I2 from phase II by stepwise solid-state iodine addition · Powder

Cu(TCNQ)I2 from solid-state reaction of phase II

Temperature: about 323-493
Atmosphere: nitrogen, based on Experimental TG method
Geometry: TG trace
Context: guest-loaded intermediate
Measurement source: p002 / article page 740 · Results · Fig. S4b

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
total TG weight loss for Cu(TCNQ)I2 from phase II	47.6% continuous weight loss labelled in Fig. S4b	—	calculated value 48.7%	Figure Axis Approximate	p002 · Supporting Information · Fig. S4

thermogravimetric analysis

Thermogravimetric analysis

Cu(TCNQ)I2 from phase I by stepwise solid-state iodine addition · Powder

Cu(TCNQ)I2 from solid-state reaction of phase I

Temperature: about 323-493
Atmosphere: nitrogen, based on Experimental TG method
Geometry: TG trace
Context: guest-loaded intermediate
Measurement source: p002 · Supporting Information · Fig. S4

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
first TG weight loss for Cu(TCNQ)I2 from phase I	23.5% first-step weight loss labelled in Fig. S4a	—	calculated value 24.3%	Figure Axis Approximate	p002 · Supporting Information · Fig. S4
total TG weight loss for Cu(TCNQ)I2 from phase I	44.8% total weight loss labelled in Fig. S4a	—	calculated value 48.7%	Figure Axis Approximate	p002 · Supporting Information · Fig. S4

X-ray fluorescence analysis, Shimadzu EDX-720

Elemental microanalysis and mapping Bulk elemental and compositional analysis

regenerated phase I Cu(TCNQ) after iodine desorption by annealing · Powder

amount of CuI in product after iodine desorption from phase I sample

Geometry: XRF elemental/phase impurity estimate
Context: regenerated Cu(TCNQ) after iodine desorption
Measurement source: p002 and p004 / article pages 740 and 742 · Results; Experimental · Fig. 3

Property	Reported value	Normalised value	Uncertainty	Origin and quality	Source
CuI impurity in phase I-derived desorbed product	about 3% CuI	—	about	Text Approximate	p002 / article page 740 · Results · Fig. 3