Geometry & MOs

Info

ID:

403221

PubChem CID:

135059232

Reduced:

ClNSO3H18C21 (1)

Stoich.:

ABCD3E18F21 (1)

Weight, g/mol:

253.146664

ΔHf, kcal/mol:

-74.22

Dipole, Da:

8.1

IP(EA), eV:

-9.38(-0.72)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-methyl-2-phenyl-N-propan-2-ylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C(=CC=C2)Cl)C(=O)NS(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations