Geometry & MOs

Info

ID:	18600
PubChem CID:	543868
Reduced:	OC27H44 (1)
Stoich.:	AB27C44 (1)
Weight, g/mol:	384.339216
ΔH_f, kcal/mol:	-99.56
Dipole, Da:	2.16
IP(EA), eV:	-9.17(1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CC=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C

DOS

IR

Vibrations