Geometry & MOs

Info

ID:	123369
PubChem CID:	50844225
Reduced:	FO2N3H20C22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	433.157246
ΔH_f, kcal/mol:	-66.95
Dipole, Da:	8.9
IP(EA), eV:	-8.76(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)F)C

DOS

IR

Vibrations