Geometry & MOs

Info

ID:	2311
PubChem CID:	6743
Reduced:	OC29H52 (1)
Stoich.:	AB29C52 (1)
Weight, g/mol:	416.401816
ΔH_f, kcal/mol:	-151.19
Dipole, Da:	2.47
IP(EA), eV:	-10.0(3.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

Drug info:

PubChemData

Smile

CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C

DOS

IR

Vibrations