Geometry & MOs

Info

ID:	70862
PubChem CID:	48413968
Reduced:	SN4O4C19H26 (1)
Stoich.:	AB4C4D19E26 (1)
Weight, g/mol:	418.086639
ΔH_f, kcal/mol:	-118.25
Dipole, Da:	6.83
IP(EA), eV:	-9.39(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-chlorophenyl)-methylsulfamoyl]-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)N3CCCCCC3)OC

DOS

IR

Vibrations