Geometry & MOs

Info

ID:	179530
PubChem CID:	76494291
Reduced:	O3N5C15H23 (1)
Stoich.:	A3B5C15D23 (1)
Weight, g/mol:	388.308979
ΔH_f, kcal/mol:	-89.44
Dipole, Da:	2.65
IP(EA), eV:	-8.98(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(dimethylamino)ethoxyiminomethyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol

Drug info:

PubChemData

Smile

CCCCCOCC1C(CC(O1)N2C=NC3=C(N=CN=C32)N)O

DOS

IR

Vibrations