Experimental Data

Click image to access powder diffraction data (.spf format)

Chemical Name

2-n-butyl-4-spirocyclopentane-1-[2'-(tetrazol-5-yl)biphenyl-4-yl) methyl]-2-imidazolin-5-one

Chemical Formula

C25H28N6O

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
• Crushed but unsieved sample
• NBS Silicon (111 reflection) calibration
• Data aquisition details:
• Date collected: 14/12/04
• File: ST1217.RAW
• 3 to 30° 2θ
• PSD step: 0.1°
• Count Time: 60 seconds per step
• Binning: 4 channels per point
• Data Step: 0.02°

• Indexed using Lzon
• Refined lattice parameters by Lebail fit:

	Unit Cell Lengths (Å):		a 10.969(1)	b 18.901(3)	c 9.508(1)
	Unit Cell Angles (°):		α 90	β 98.267(7)	γ 90
	Unit Cell Volume (Ų):		1951

• Z: 4
• System: Monoclinic
• Possible Space Group: P2

Reference

European Patent number: EP1275391