Geometry & MOs

Info

ID:	448639
PubChem CID:	135292410
Reduced:	N2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	384.23006
ΔH_f, kcal/mol:	29.14
Dipole, Da:	1.95
IP(EA), eV:	-8.1(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(5R,8R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pyran-2-one

Drug info:

PubChemData

Smile

C/C=C(\C(=C/C)\N(C)CCCCC(=C)C)/N=C

DOS

IR

Vibrations