Geometry & MOs

Info

ID:

17988

PubChem CID:

531875

Reduced:

ClNOH14C15 (1)

Stoich.:

ABCD14E15 (1)

Weight, g/mol:

259.076392

ΔHf, kcal/mol:

-16.08

Dipole, Da:

6.28

IP(EA), eV:

-9.05(-0.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-4-ethylbenzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)Cl

DOS

IR

Vibrations