Geometry & MOs

Info

ID:	185926
PubChem CID:	77369738
Reduced:	SN2O3C23H36 (1)
Stoich.:	AB2C3D23E36 (1)
Weight, g/mol:	420.244664
ΔH_f, kcal/mol:	-136.95
Dipole, Da:	4.16
IP(EA), eV:	-8.88(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(17-ethenyl-17-hydroxy-4,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-ylidene)amino]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=C2C(=C)CC3C(C2(CCC1=NNS(=O)(=O)C)C)CCC4(C3CCC4(C)O)C

DOS

IR

Vibrations