Geometry & MOs

Info

ID:	131055
PubChem CID:	51148965
Reduced:	NO4C13H15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	329.119798
ΔH_f, kcal/mol:	-84.49
Dipole, Da:	4.08
IP(EA), eV:	-8.7(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylsulfanylphenyl)-2-(phenylcarbamoylamino)propanamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)N(C)OC

DOS

IR

Vibrations