Geometry & MOs

Info

ID:	125989
PubChem CID:	50947107
Reduced:	SO2N6C23H28 (1)
Stoich.:	AB2C6D23E28 (1)
Weight, g/mol:	361.109627
ΔH_f, kcal/mol:	3.0
Dipole, Da:	8.32
IP(EA), eV:	-8.06(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-carbamoylphenyl)-3-methyl-4-[methyl(methylsulfonyl)amino]benzamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=C(C=C(C(=C4)C)C)C

DOS

IR

Vibrations