Geometry & MOs

Info

ID:

129424

PubChem CID:

51072539

Reduced:

N2O4C19H28 (1)

Stoich.:

A2B4C19D28 (1)

Weight, g/mol:

328.101227

ΔHf, kcal/mol:

-170.78

Dipole, Da:

5.89

IP(EA), eV:

-8.52(-0.02)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-(2-chlorophenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide

Drug info:

PubChemData

Smile

CC(C)CCOC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N)OC

DOS

IR

Vibrations