Geometry & MOs

Info

ID:	38017
PubChem CID:	8026413
Reduced:	NSO4C19H21 (1)
Stoich.:	ABC4D19E21 (1)
Weight, g/mol:	414.11619
ΔH_f, kcal/mol:	-105.58
Dipole, Da:	6.05
IP(EA), eV:	-8.86(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-(3-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCC[C@H]2C3=CC=CS3)OC

DOS

IR

Vibrations