caa a22 4500 46323880X CHVBK 20180405153306.0 cr unu---uuuuu 170326e20070101xx s 000 0 eng 10.1007/s10947-007-0032-x doi (NATIONALLICENCE)springer-10.1007/s10947-007-0032-x Crystal structure of olanzapinium benzoate (1:1) [Elektronische Daten] [B. Sridhar, K. Ravikumar] Olanzapinium benzoate, 1-methyl-4-(2-methyl-10H-thieno[2,3-b][1,5]benzodiazepin-4-yl)-piperazin-1-ium benzoate, (C17H21N4S)+(C7H5O2)− (I), crystallizes in triclinic space group P-1 with unit cell dimensions a = 9.2957(6) Å, b = 11.2416(7) Å, c = 12.0003(8) Å; α = 64.585(1)°, β = 87.568(1)°, γ = 83.248(1)°; V = 1124.8(1) Å3. The asymmetric part of the structure comprises a singly charged olanzapinium cation and a singly charged benzoate anion. The central 1,5-diazepine ring adopts the expected boat conformation, while the piperazine ring favors the chair conformation. The olanzapinium and benzoate ions are linked by intermolecular N-H...O hydrogen bonds forming infinite chains running along the c-axis of the crystal. Springer Science+Business Media, Inc., 2007 ZYPREXA nationallicence atypical agents nationallicence piperazine nationallicence protonation nationallicence intermolecular hydrogen bond nationallicence Sridhar B. Laboratopy of X-ray Crystallography, Indian Institute of Chemical Technology, 500007, Hyderabad, India aut Ravikumar K. Laboratopy of X-ray Crystallography, Indian Institute of Chemical Technology, 500007, Hyderabad, India aut Journal of Structural Chemistry Kluwer Academic Publishers-Consultants Bureau 48/1(2007-01-01), 198-202 0022-4766 48:1<198 2007 48 10947 https://doi.org/10.1007/s10947-007-0032-x text/html Onlinezugriff via DOI 1 research-article jats NATIONALLICENCE 856 40 https://doi.org/10.1007/s10947-007-0032-x text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- Sridhar B. Laboratopy of X-ray Crystallography, Indian Institute of Chemical Technology, 500007, Hyderabad, India aut NATIONALLICENCE 700 1- Ravikumar K. Laboratopy of X-ray Crystallography, Indian Institute of Chemical Technology, 500007, Hyderabad, India aut NATIONALLICENCE 773 0- Journal of Structural Chemistry Kluwer Academic Publishers-Consultants Bureau 48/1(2007-01-01), 198-202 0022-4766 48:1<198 2007 48 10947 Metadata rights reserved Springer special CC-BY-NC licence nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-springer