1-(6-{[(17α)-3-Methoxyestra-1,3,5(10)-Trien-17-Yl]Amino}Hexyl)-1H-Pyrrole-2,5-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C29H40N2O3
IUPAC Name 1-[6-[[(8r,9r,13s,14r,17r)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]amino]hexyl]pyrrole-2,5-dione
Molecular Mass 464.640 g·mol−1
Heat of Formation -499.6 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 595.91 Å 3
Surface Area 413.69 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
InChIKey LUFAORPFSVMJIW-GRDIGNMCSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N