Geometry & MOs

Info

ID:

219369

PubChem CID:

85148327

Reduced:

N2O3C30H40 (1)

Stoich.:

A2B3C30D40 (1)

Weight, g/mol:

476.404958

ΔHf, kcal/mol:

-106.1

Dipole, Da:

7.61

IP(EA), eV:

 -8.18(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[3-[tert-butyl(dimethyl)silyl]oxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentan-1-ol

Drug info:

PubChemData

Smile

CCCC(=O)NC1=C(C=CC(=C1)N)OC(=O)C=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C

DOS

IR

Vibrations