Geometry & MOs

Info

ID:	322520
PubChem CID:	126670359
Reduced:	NC8H16 (2)
Stoich.:	AB8C16 (2)
Weight, g/mol:	358.250795
ΔH_f, kcal/mol:	-37.55
Dipole, Da:	1.12
IP(EA), eV:	-8.34(2.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10R,13S)-10,13-dimethyl-17-(2-methyl-1,3-dioxolan-2-yl)-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Drug info:

PubChemData

Smile

CC(C)(C)N1CC(C1)CC(C)(C)N2CCCCC2

DOS

IR

Vibrations