Geometry & MOs

Info

ID:

383328

PubChem CID:

134974993

Reduced:

O4C17H26 (1)

Stoich.:

A4B17C26 (1)

Weight, g/mol:

296.209993

ΔHf, kcal/mol:

-199.68

Dipole, Da:

3.53

IP(EA), eV:

-9.46(0.12)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-(1-aminopentyl)-5,8a-dihydroxy-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CCCC/C=C(\CC1=C(CC(CC1=O)(C)C)O)/C(=O)OC

DOS

IR

Vibrations