Geometry & MOs

Info

ID:

393909

PubChem CID:

135021946

Reduced:

O2C15H24 (1)

Stoich.:

A2B15C24 (1)

Weight, g/mol:

204.187801

ΔHf, kcal/mol:

-118.78

Dipole, Da:

2.47

IP(EA), eV:

-9.65(0.92)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3aR,7aS)-3,3,4,5,7a-pentamethyl-2-methylidene-1,3a,6,7-tetrahydroindene

Drug info:

PubChemData

Smile

CC(C)[C@]12CC[C@](O1)([C@@H]3CC[C@](C3=C2)(C)O)C

DOS

IR

Vibrations