Geometry & MOs

Info

ID:	342296
PubChem CID:	127265073
Reduced:	NOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	355.110296
ΔH_f, kcal/mol:	-12.51
Dipole, Da:	5.58
IP(EA), eV:	-9.48(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-methyl-2-(6-methylpyridazin-3-yl)pyrazol-3-yl]-2-phenylethenesulfonamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C=CC2=CN=CC=C2)CC(=O)C3=CC=CC=C3

DOS

IR

Vibrations