Geometry & MOs

Info

ID:	70942
PubChem CID:	48414073
Reduced:	SO3N4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	322.109962
ΔH_f, kcal/mol:	-80.87
Dipole, Da:	2.06
IP(EA), eV:	-9.41(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylsulfamoyl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3CCCCC3

DOS

IR

Vibrations