Investigation of Aripiprazole
Martin
Vickers
4th November 2005
This page was updated 16th December 2008 to include a fuller range
data set
Experimental Data
Click image to access powder diffraction data (.spf format)
Chemical Name
7-[4-[4-(2,3-dichlorophenyl)-1- piperazinyl]butoxy]-3,4-dihydrocarbostyril
Chemical Formula
C23H27Cl2N3O2 |
 |
Preparation and Instrumentation Parameters
- Stoe StadiP transmission (capillary) Powder Diffractometer
- Cu Kα1 X-ray radiation
- Pre-sample germanium monochromator
- 40kV/30mA generator power
- Linear Position Sensitive Detector 6° 2θ range
- Rotating 0.5mm sample capillary
- sieved 100μm, uncrushed sample
- NBS Silicon (111 reflection) calibration
- Data aquisition details:
- Date collected: 15/12/08
- File: ST3387.RAW. Replaces ST1432.RAW
- ×2 ranges from 2 to 45° 2θ and summed
- PSD step: 0.2°
- Count Time: 160 seconds per step
- Binning: 4 channels per point
- Data Step: 0.02°
Results
- Indexed using TREOR90
- Refined lattice parameters by Lebail fit:
| Unit Cell Lengths (Å): |
|
a 10.195(1) |
b 12.163(1) |
c 18.750(1) |
|
| Unit Cell Angles (°): |
|
α 82.171(2) |
β 97.533(3) |
γ 97.143(3) |
| Unit Cell Volume (Ų): |
| 2271 |
- Z: 4
- System: Triclinic
- Space Group: P1 or P-1
Reference
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