Information card for entry 2007201

Structure parameters

• Common name: D-PHENYLGLYCINE HYDROCHLORIDE
• Chemical name: D-α-Aminophenyl acetic acid hydrochloride
• Formula: C8 H10 Cl N O2
• Calculated formula: C8 H10 Cl N O2
• SMILES: [Cl-].O=C(O)[C@H]([NH3+])c1ccccc1
• Title of publication: <small>D</small>-Phenylglycine Hydrochloride
• Authors of publication: Ravichandran, S.; Dattagupta, J. K.; Chakrabarti, Chandana
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 4
• Pages of publication: 499 - 501
• a: 5.4376 ± 0.0005 Å
• b: 7.2577 ± 0.0008 Å
• c: 22.773 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 898.72 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for all reflections: 0.127
• Weighted residual factors for significantly intense reflections: 0.106
• Goodness-of-fit parameter for all reflections: 0.768
• Goodness-of-fit parameter for significantly intense reflections: 0.747
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No