Logo

96SRC064 (1078) - C26H38CdI4N6O4

Sample Originator: Mohamed Kurmooa.

Data Collection: Simon J. Colesb and Michael B. Hursthouseb

Structure Determination: Simon J. Colesb.

Royal Institutiona
University of Southamptonb

C26H38CdI4N6O4

InChI=1/2C13H22N3O2.Cd.4HI/c2*1-12(2)13(3,4)16(18)11(15(12)17)10-6-8-14(5)9-7-10;;;;;/h2*6-9,11,17-18H,1-5H3;;4*1H/q;;+4;;;;/p-4

Date Created:11 March 1996
Deposited On:23 Dec 2014 13:35
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC26 H38 Cd I4 N6 O4
Crystal morphology
Crystal systemMonoclinic
Space group symbolP2(1)/c
Cell length a16.249(5)
Cell length b10.8064(10)
Cell length c21.254(5)
Cell angle alpha90.00
Cell angle beta105.93(2)
Cell angle gamma90.00
Data collection temperature150(2)

Refinement results

Solution figure of merit
R Factor (Obs)
R Factor (All)0.0891
Weighted R Factor (Obs)
Weighted R Factor (All)

Citation: Kurmoo, Mohamed and Coles, Simon J. and Hursthouse, Michael B. (1996) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/759/)
Export as: oreChem EndNote BibTeX ASCII Citation

Available Files

Final Result

96SRC064.cml11k
96src064.CIF17k

Validation

96src064_checkcif.htm19k

Refinement

96SRC064.res8k

Processing

96src064.HKL428k

Other Files

96SRC064.inchi3k
96SRC064.mol6k
96src064.txt17k
96src064_ellipsoid.gif23k

Warning

This item is embargoed, The embargo will be lifted on 20 August 2009. This is only viewable by the authors and respository staff, If you would like to show this item to a guest, share this url: http://ecrystals.chem.soton.ac.uk/759/?key=2f8e073d59f4cc4337a4e41ec01f3c0f

Repository Staff Only: item control page