Geometry & MOs

Info

ID:

14864

PubChem CID:

422984

Reduced:

NO2C16H21 (1)

Stoich.:

AB2C16D21 (1)

Weight, g/mol:

259.157229

ΔHf, kcal/mol:

-77.63

Dipole, Da:

3.47

IP(EA), eV:

-9.13(0.0)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-(cyclohexylamino)-5-phenyloxolan-2-one

Drug info:

PubChemData

Smile

C1CCC(CC1)NC2CC(OC2=O)C3=CC=CC=C3

DOS

IR

Vibrations