Geometry & MOs

Info

ID:	156926
PubChem CID:	56394877
Reduced:	O3Cl4N4H10C18 (1)
Stoich.:	A3B4C4D10E18 (1)
Weight, g/mol:	444.140925
ΔH_f, kcal/mol:	-36.63
Dipole, Da:	4.96
IP(EA), eV:	-8.99(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-N-[3-methyl-2-(methylcarbamoyl)phenyl]-4-oxo-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OC2=NC=C(C=C2)NC(=O)C3=NC(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)N

DOS

IR

Vibrations