Geometry & MOs

Info

ID:

180823

PubChem CID:

76691229

Reduced:

N2O2C19H36 (1)

Stoich.:

A2B2C19D36 (1)

Weight, g/mol:

182.167065

ΔHf, kcal/mol:

-133.89

Dipole, Da:

4.0

IP(EA), eV:

-8.65(0.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4,4,7a-trimethyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-ol

Drug info:

PubChemData

Smile

CCN(CC)CCN(C)C(=O)C1CCCCC1C(=O)C(C)(C)C

DOS

IR

Vibrations