Crystallography Open Database

Information card for entry 7241996

7241995 << 7241996 >> 7241997

Preview

Coordinates	7241996.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H15 N5 Na O8 P
Calculated formula	C10 H15 N5 Na O8 P
Title of publication	Hydrates of adenosine 3′,5′-cyclic monophosphate sodium and their transformation
Authors of publication	Yang, Pengpeng; Jin, Junyang; Wen, Qingshi; Lin, Chenguang; Fu, JinQiu; Zhuang, Wei; Wu, Jinglan; Liu, Dong; Zhu, Chenjie; Ying, Hanjie
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	1
Pages of publication	174 - 184
a	10.9535 ± 0.0015 Å
b	10.9535 ± 0.0015 Å
c	22.449 ± 0.005 Å
α	90°
β	90°
γ	120°
Cell volume	2332.6 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	154
Hermann-Mauguin space group symbol	P 32 2 1
Hall space group symbol	P 32 2"
Residual factor for all reflections	0.0825
Residual factor for significantly intense reflections	0.0547
Weighted residual factors for significantly intense reflections	0.1413
Weighted residual factors for all reflections included in the refinement	0.1582
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
261585 (current)	2021-02-05	cif/ Updating files of 7241995, 7241996 Original log message: Adding full bibliography for 7241995--7241996.cif.	7241996.cif
260334	2021-01-01	cif/ Adding structures of 7241995, 7241996 via cif-deposit CGI script.	7241996.cif