Geometry & MOs

Info

ID:	172194
PubChem CID:	75477161
Reduced:	OSN4C16H16 (1)
Stoich.:	ABC4D16E16 (1)
Weight, g/mol:	342.115047
ΔH_f, kcal/mol:	58.4
Dipole, Da:	1.92
IP(EA), eV:	-9.19(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylphenyl)-N-(4-methyl-5-pyridin-4-yl-1H-pyrazol-3-yl)methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=CSC(=N2)NC(=O)CCN3C=CC=N3

DOS

IR

Vibrations