Geometry & MOs

Info

ID:

53959

PubChem CID:

14718461

Reduced:

NSiO2C24H39 (1)

Stoich.:

ABC2D24E39 (1)

Weight, g/mol:

471.353256

ΔHf, kcal/mol:

-166.6

Dipole, Da:

5.72

IP(EA), eV:

 -9.74(0.72)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O[Si](C)(C)CCC#N

DOS

IR

Vibrations