Geometry & MOs

Info

ID:	395494
PubChem CID:	135025596
Reduced:	NC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	354.183109
ΔH_f, kcal/mol:	-17.92
Dipole, Da:	2.38
IP(EA), eV:	-9.49(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (8S,9R,11S,14S)-17-acetyl-2-methoxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-11-carboxylate

Drug info:

PubChemData

Smile

CCCCCC1=NC(=NC2=C1CCCCCC2)C

DOS

IR

Vibrations