Geometry & MOs

Info

ID:

20153

PubChem CID:

580389

Reduced:

OC16H28 (2)

Stoich.:

AB16C28 (2)

Weight, g/mol:

472.428031

ΔHf, kcal/mol:

-75.95

Dipole, Da:

2.77

IP(EA), eV:

 -6.84(-0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

10,13-dimethyl-17-(6-methylheptan-2-yl)-2-propan-2-ylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CC(C5(C4)OCCO5)C(C)C)C)C

DOS

IR

Vibrations