Geometry & MOs

Info

ID:	191585
PubChem CID:	78164850
Reduced:	ClON2H21C24 (1)
Stoich.:	ABC2D21E24 (1)
Weight, g/mol:	300.245316
ΔH_f, kcal/mol:	38.27
Dipole, Da:	3.6
IP(EA), eV:	-9.39(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10,13,17-trimethyl-3-methylidene-5,6,7,8,9,11,12,14,15,16-decahydro-4H-cyclopenta[a]phenanthren-17-ol

Drug info:

PubChemData

Smile

CC1CN(C2(N1C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

DOS

IR

Vibrations