Ampicillin trihydrate from synchrotron powder diffraction data

被引：19

作者：

Burley, JC

van de Streek, J

Stephens, PW

机构：

[1] Univ Cambridge, Chem Lab, Cambridge CB2 1EW, England

[2] Cambridge Crystallog Data Ctr, Cambridge CB2 1EZ, England

[3] SUNY Stony Brook, Dept Phys & Astron, Stony Brook, NY 11794 USA

来源：

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2006年 / 62卷

关键词：

D O I：

10.1107/S1600536806001371

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

The crystal structure of ampicillin trihydrate {systematic name: 6-[D(-)-alpha-aminophenylacetamido]penicillanic acid trihydrate}, C16H19N3O4S center dot 3H(2)O, a broad-spectrum beta-lactam antibiotic of the aminopenicillin type, has been determined from synchrotron X-ray powder diffraction data. The three water molecules form an infinite hydrogen-bonded chain through the crystal structure, with hydrogen bonds to the NH3+, COO-, C=O and NH groups of the ampicillin molecules.

引用

页码：O797 / O799

页数：3

共 11 条

[1] The Cambridge Structural Database: a quarter of a million crystal structures and rising [J].

Allen, FH .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 2002, 58 (3 PART 1) :380-388

[2] STRUCTURES OF AMPICILLIN - COMPARISON OF ANHYDRATE AND TRIHYDRATE FORMS [J].

BOLES, MO ;

GIRVEN, RJ .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1976, 32 (AUG15) :2279-2284

[3] STRUCTURE OF AMOXYCILLIN TRIHYDRATE AND A COMPARISON WITH STRUCTURES OF AMPICILLIN [J].

BOLES, MO ;

GIRVEN, RJ ;

GANE, PAC .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1978, 34 (FEB) :461-466

[4] INDEXING OF POWDER DIFFRACTION PATTERNS FOR LOW-SYMMETRY LATTICES BY THE SUCCESSIVE DICHOTOMY METHOD [J].

BOULTIF, A ;

LOUER, D .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1991, 24 (pt 6) :987-993

[5]

David W. I. F., 2004, DASH VERSION 3 0

[6] Background estimation using a robust Bayesian analysis [J].

David, WIF ;

Sivia, DS .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2001, 34 :318-324

[7] A CORRECTION FOR POWDER DIFFRACTION PEAK ASYMMETRY DUE TO AXIAL DIVERGENCE [J].

FINGER, LW ;

COX, DE ;

JEPHCOAT, AP .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1994, 27 :892-900

[8] CRYSTALLINE MODIFICATIONS OF AMPICILLIN I - TRIHYDRATE [J].

JAMES, MNG ;

HALL, D ;

HODGKIN, DC .

NATURE, 1968, 220 (5163) :168-&

[9]

Larson A. C., 2000, LAUR86748

[10] Single-crystal structure validation with the program PLATON [J].

Spek, AL .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2003, 36 :7-13

← 1 2 →