Crystallography Open Database

Information card for entry 4514539

Preview

Coordinates	4514539.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36.5 H33 Br2 Cl N2 Pt Si2
Calculated formula	C36.5 H33 Br2 Cl N2 Pt Si2
SMILES	ClCCl.[n]12cc(ccc1c1ccc(C#C[Si](C)(C)C)c[n]1[Pt]2(C#Cc1cccc(c1)Br)C#Cc1cccc(c1)Br)C#C[Si](C)(C)C
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	13.8249 ± 0.0018 Å
b	14.5831 ± 0.0019 Å
c	20.362 ± 0.003 Å
α	75.309 ± 0.002°
β	80.795 ± 0.002°
γ	67.378 ± 0.002°
Cell volume	3656.5 ± 0.9 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	0.0491
Residual factor for significantly intense reflections	0.0355
Weighted residual factors for significantly intense reflections	0.0799
Weighted residual factors for all reflections included in the refinement	0.0866
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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
254431 (current)	2020-07-21	cif/4 Fixing Z values and formulae	4514539.cif
219724	2019-10-28	cif/ Adding structures of 4514539 via cif-deposit CGI script.	4514539.cif