Crystallography Open Database

Information card for entry 4514532

Preview

Coordinates	4514532.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H40 Br2 N2 O Pt Si2
Calculated formula	C40 H40 Br2 N2 O Pt Si2
SMILES	[Pt]1([n]2cc(C#C[Si](C)(C)C)ccc2c2[n]1cc(C#C[Si](C)(C)C)cc2)(C#Cc1cc(Br)ccc1)C#Cc1cccc(c1)Br.O1CCCC1
Title of publication	Facile and Equipment-Free Data Encryption and Decryption by Self-Encrypting Pt(II) Complex.
Authors of publication	Kang, Jiajia; Ni, Jun; Su, Mengmeng; Li, Yanqin; Zhang, Jianjun; Zhou, Huajun; Chen, Zhong-Ning
Journal of publication	ACS applied materials & interfaces
Year of publication	2019
Journal volume	11
Journal issue	14
Pages of publication	13350 - 13358
a	10.4734 ± 0.0008 Å
b	11.0967 ± 0.0009 Å
c	18.1385 ± 0.0014 Å
α	100.647 ± 0.001°
β	92.198 ± 0.001°
γ	99.525 ± 0.001°
Cell volume	2038 ± 0.3 Å³
Cell temperature	210 ± 2 K
Ambient diffraction temperature	210 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0381
Residual factor for significantly intense reflections	0.0322
Weighted residual factors for significantly intense reflections	0.0776
Weighted residual factors for all reflections included in the refinement	0.0805
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
219717 (current)	2019-10-28	cif/ Adding structures of 4514532 via cif-deposit CGI script.	4514532.cif