Geometry & MOs

Info

ID:

53955

PubChem CID:

14718457

Reduced:

NSiO2C23H31 (1)

Stoich.:

ABC2D23E31 (1)

Weight, g/mol:

497.405292

ΔHf, kcal/mol:

-125.18

Dipole, Da:

6.05

IP(EA), eV:

 -9.0(0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy-dimethylsilyl]propanenitrile

Drug info:

PubChemData

Smile

C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)O[Si](C)(C)CCC#N

DOS

IR

Vibrations