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Information card for entry 2017769
Preview
Coordinates | 2017769.cif |
---|---|
Original IUCr paper | HTML |
Common name | meso-hexamethyl propylene amine oxime (meso-HMPAO) |
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Chemical name | <i>meso</i>-3,3'-[2,2-dimethylpropane-1,3-diylbis(azanediyl)]dibutan-2-one dioxime |
Formula | C13 H28 N4 O2 |
Calculated formula | C13 H28 N4 O2 |
SMILES | C(C)(C)(CN[C@@H](C)C(\C)=N\O)CN[C@H](C)C(=N\O)\C |
Title of publication | Powder X-ray studies of <i>meso</i>-hexamethyl propylene amine oxime (<i>meso</i>-HMPAO) in two different phases |
Authors of publication | Al-Ktaifani, Mahmoud; Rukiah, Mwaffak |
Journal of publication | Acta Crystallographica, Section C |
Year of publication | 2010 |
Journal volume | 66 |
Journal issue | 9 |
Pages of publication | o479 - o483 |
a | 16.4453 ± 0.0004 Å |
b | 15.9587 ± 0.0003 Å |
c | 6.20073 ± 0.00011 Å |
α | 90° |
β | 94.7097 ± 0.0013° |
γ | 90° |
Cell volume | 1621.86 ± 0.06 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Goodness-of-fit parameter for all reflections | 1.16 |
Method of determination | powder diffraction |
Diffraction radiation wavelength | 1.5406 Å |
Diffraction radiation type | CuKα~1~ |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
2017769.cif |
125873 | 2014-10-25 | cod/ (saulius@koala.ibt.lt) Adding DOIs to 1887 Acta Cryst. CIFs, their DOIs fetched using ACCE codes. |
2017769.cif |
26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2017769.cif |
3811 | 2010-11-21 | ../uploads/cif-deposit/cod/cif Adding structures of 2017768, 2017769 via cif-deposit CGI script. |
2017769.cif |
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