Geometry & MOs

Info

ID:	70754
PubChem CID:	48413822
Reduced:	ClSO3N4C16H19 (1)
Stoich.:	ABC3D4E16F19 (1)
Weight, g/mol:	384.102289
ΔH_f, kcal/mol:	-78.09
Dipole, Da:	3.54
IP(EA), eV:	-9.56(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-[methyl(propan-2-yl)sulfamoyl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

DOS

IR

Vibrations