#------------------------------------------------------------------------------
#$Date: 2008-01-26 17:25:03 +0000 (Sat, 26 Jan 2008) $
#$Revision: 20 $
#$URL: svn://www.crystallography.net/cod/cif/2/2005130.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_2005130
_journal_name_full  'Acta Crystallographica'
_journal_year      1996
_journal_volume    	C52
_journal_page_first    	1733
_journal_page_last    	1736
_publ_section_title
;
Tris(n-propyl)phosphine and Tris(isopropyl)phosphine
;
_chemical_formula_sum    	'C9 H21 P'
_chemical_formula_weight    	160.24
_symmetry_cell_setting    	triclinic
loop_
_symmetry_equiv_pos_as_xyz
'x,y,z'
'-x,-y,-z'
_symmetry_space_group_name_H-M    	'P -1'
_cell_length_a    	5.579(2)
_cell_length_b    	8.014(2)
_cell_length_c    	12.014(2)
_cell_angle_alpha    	95.72(1)
_cell_angle_beta    	95.72(1)
_cell_angle_gamma    	92.54(2)
_cell_volume    	531.0(2)
_cell_formula_units_Z    	2
_exptl_crystal_density_diffrn    	1.00
_cell_measurement_temperature    	102
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_u_iso_or_equiv
P .4375(1) .2843(1) .8379(1) .021(1)
C1 .5105(3) .1008(2) .7434(1) .022(1)
C2 .7456(3) .1077(2) .6885(1) .025(1)
C3 .7812(3) -.0545(2) .6163(1) .030(1)
C4 .7163(3) .3241(2) .9351(1) .022(1)
C5 .7498(3) .1903(2) 1.0162(1) .027(1)
C6 .9681(3) .2296(3) 1.1023(2) .033(1)
C7 .4711(3) .4588(2) .7502(1) .023(1)
C8 .2677(3) .4576(2) .6551(1) .026(1)
C9 .2799(4) .6140(2) .5936(2) .034(1)
H1a .514(4) .006(3) .785(2) ?
H1b .379(4) .078(2) .687(2) ?
H2a .750(4) .202(3) .646(2) ?
H2b .879(4) .132(2) .747(2) ?
H3a .928(5) -.055(3) .583(2) ?
H3b .768(4) -.149(3) .659(2) ?
H3c .662(4) -.074(2) .556(2) ?
H4a .700(3) .427(2) .975(2) ?
H4b .862(4) .333(2) .895(2) ?
H5a .761(4) .082(3) .976(2) ?
H5b .610(4) .176(2) 1.053(2) ?
H6a 1.109(5) .241(3) 1.067(2) ?
H6b .988(5) .151(3) 1.150(2) ?
H6c .954(5) .336(3) 1.143(2) ?
H7a .471(4) .560(2) .797(2) ?
H7b .632(4) .459(2) .723(2) ?
H8a .281(4) .362(3) .605(2) ?
H8b .116(4) .449(2) .685(2) ?
H9a .431(5) .616(3) .560(2) ?
H9b .276(4) .712(3) .647(2) ?
H9c .160(5) .608(3) .533(2) ?