Crystallography Open Database

Information card for entry 7100716

Preview

Coordinates	7100716.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H34 Br9 N4 O3.5 Zn
Calculated formula	C49 H29 Br9 N4 O3.5 Zn
Title of publication	Unexpected bromination ring opening of tetraarylporphyrins
Authors of publication	Qing-Yun Chen; Chao Liu; Dong-Mei Shen
Journal of publication	Chemical Communications
Year of publication	2006
a	28.025 ± 0.0016 Å
b	14.0764 ± 0.0008 Å
c	26.7094 ± 0.0015 Å
α	90°
β	102.31 ± 0.001°
γ	90°
Cell volume	10294.4 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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