Crystallography Open Database

Information card for entry 2000460

2000459 << 2000460 >> 2000461

Preview

Coordinates	2000460.cif
Original IUCr paper	HTML

Structure parameters

Formula	C18 H16 O4
Calculated formula	C18 H16 O4
SMILES	CCOC(=O)Cc1ccc2c(c1)C(=O)c1ccccc1CO2
Title of publication	Structural aspects of the 6,11-dihydro-11-oxodibenz[<i>b</i>,<i>e</i>]oxepin skeleton
Authors of publication	Matsuzawa, E. S.; Hirayama, N.; Ohshima, E.; Obase, H.
Journal of publication	Acta Crystallographica Section C
Year of publication	1992
Journal volume	48
Journal issue	11
Pages of publication	2016 - 2019
a	10.177 ± 0.001 Å
b	10.63 ± 0.001 Å
c	7.776 ± 0.001 Å
α	103.72 ± 0.01°
β	100.7 ± 0.01°
γ	107.85 ± 0.01°
Cell volume	746.9 ± 0.16 Å³
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	Cu
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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