Geometry & MOs

Info

ID:	61754
PubChem CID:	26712541
Reduced:	SN2O4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	408.091056
ΔH_f, kcal/mol:	-129.44
Dipole, Da:	7.52
IP(EA), eV:	-9.26(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[3-(diethylcarbamoyl)phenyl]-3-methylsulfonylbenzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C

DOS

IR

Vibrations