Geometry & MOs

Info

ID:	63866
PubChem CID:	26759351
Reduced:	NSO2C10H12 (2)
Stoich.:	ABC2D10E12 (2)
Weight, g/mol:	466.156243
ΔH_f, kcal/mol:	-124.04
Dipole, Da:	10.22
IP(EA), eV:	-9.07(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-4-(phenoxymethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=CC=CC=C3C

DOS

IR

Vibrations