Geometry & MOs

Info

ID:

165406

PubChem CID:

74546696

Reduced:

NO2C14H21 (1)

Stoich.:

AB2C14D21 (1)

Weight, g/mol:

258.173213

ΔHf, kcal/mol:

-46.75

Dipole, Da:

3.34

IP(EA), eV:

-8.65(-0.16)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[(hexylamino)methyl]-3H-quinolin-2-one

Drug info:

PubChemData

Smile

CCC(=NO)C1=CC=CC=C1OCCC(C)C

DOS

IR

Vibrations