Crystallography Open Database

Information card for entry 1552172

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Structure parameters

Formula	C14 H24 N8 O4 Pt
Calculated formula	C14 H24 N8 O4 Pt
SMILES	O[Pt]([n]1cccc(c1)C)([n]1cccc(c1)C)(N=N#N)(N=N#N)O.CO.CO
Title of publication	Platinum(iv) dihydroxido diazido N-(heterocyclic)imine complexes are potently photocytotoxic when irradiated with visible light
Authors of publication	Shaili, Evyenia; Salassa, Luca; Woods, Julie A.; Clarkson, Guy; Sadler, Peter J.; Farrer, Nicola J.
Journal of publication	Chemical Science
Year of publication	2019
a	7.09413 ± 0.00013 Å
b	11.18048 ± 0.0002 Å
c	12.327 ± 0.0002 Å
α	90°
β	90.6038 ± 0.0017°
γ	90°
Cell volume	977.67 ± 0.03 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0264
Residual factor for significantly intense reflections	0.0185
Weighted residual factors for significantly intense reflections	0.0409
Weighted residual factors for all reflections included in the refinement	0.0455
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301780 (current)	2025-08-19	Add cross-references to PubChem compounds in COD range 1/55 Each referenced PubChem compound corresponds to the full crystal structure.	1552172.cif
217469	2019-08-09	cif/ Adding structures of 1552170, 1552171, 1552172, 1552173, 1552174 via cif-deposit CGI script.	1552172.cif