Crystallography Open Database

Information card for entry 7703240

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Coordinates	7703240.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H104 In4 N8 O1.96
Calculated formula	C72 H104 In4 N8 O1.9552
Title of publication	Facile oxidative addition of O<sub>2</sub> and S<sub>8</sub> by an indium bis(carbene) analogue.
Authors of publication	Desat, Marcella E.; Kretschmer, Robert
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	48
Pages of publication	17718 - 17722
a	11.7484 ± 0.0002 Å
b	12.834 ± 0.0003 Å
c	14.8693 ± 0.0003 Å
α	106.288 ± 0.002°
β	110.634 ± 0.002°
γ	98.668 ± 0.002°
Cell volume	1934.67 ± 0.08 Å³
Cell temperature	123.01 ± 0.16 K
Ambient diffraction temperature	123.01 ± 0.16 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0232
Residual factor for significantly intense reflections	0.0207
Weighted residual factors for significantly intense reflections	0.0499
Weighted residual factors for all reflections included in the refinement	0.051
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
246605 (current)	2020-01-05	cif/ Adding structures of 7703238, 7703239, 7703240 via cif-deposit CGI script.	7703240.cif