Geometry & MOs

Info

ID:	131637
PubChem CID:	51237276
Reduced:	S2O3N4C17H22 (1)
Stoich.:	A2B3C4D17E22 (1)
Weight, g/mol:	377.173942
ΔH_f, kcal/mol:	-78.82
Dipole, Da:	4.8
IP(EA), eV:	-8.63(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methoxy-5-methylphenyl)methyl]-N,6-dimethyl-4-oxo-1-phenylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3CCS(=O)(=O)C3)C

DOS

IR

Vibrations