Crystallography Open Database

Information card for entry 7242897

Preview

Coordinates	7242897.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H8 O3
Calculated formula	C10 H8 O3
SMILES	c1(=O)ccc2ccc(cc2o1)OC
Title of publication	Photoinduced topographical surface changes and photoresponse of the crystals of 7-methoxycoumarin
Authors of publication	Yano, Kanae; Nishimura, Ryo; Hattori, Yohei; Morimoto, Masakazu; Sugiyama, Haruki; Kamitanaka, Takashi; Yokojima, Satoshi; Nakamura, Shinichio; Uchida, Kingo
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	34
Pages of publication	5780 - 5787
a	6.8137 ± 0.0003 Å
b	10.6684 ± 0.0005 Å
c	12.4313 ± 0.0006 Å
α	108.189 ± 0.0015°
β	95.2297 ± 0.0015°
γ	95.2045 ± 0.0015°
Cell volume	848.11 ± 0.07 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0868
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1386
Weighted residual factors for all reflections included in the refinement	0.1625
Goodness-of-fit parameter for all reflections included in the refinement	1.114
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKa
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
268677 (current)	2021-09-06	cif/ Updating files of 7242895, 7242896, 7242897, 7242898 Original log message: Adding full bibliography for 7242895--7242898.cif.	7242897.cif
265464	2021-05-24	cif/ Adding structures of 7242895, 7242896, 7242897, 7242898 via cif-deposit CGI script.	7242897.cif