Geometry & MOs

Info

ID:	176786
PubChem CID:	76099453
Reduced:	N2O3C20H38 (1)
Stoich.:	A2B3C20D38 (1)
Weight, g/mol:	360.20893
ΔH_f, kcal/mol:	-211.71
Dipole, Da:	2.12
IP(EA), eV:	-10.09(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)-phenylmethanone

Drug info:

PubChemData

Smile

CCCCCCCCN1C(CC(=O)N(C1=O)CCCCCCCC)O

DOS

IR

Vibrations