Geometry & MOs

Info

ID:	343306
PubChem CID:	127266479
Reduced:	N4O4H18C19 (1)
Stoich.:	A4B4C18D19 (1)
Weight, g/mol:	452.082223
ΔH_f, kcal/mol:	-32.41
Dipole, Da:	8.3
IP(EA), eV:	-8.45(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(Z)-[4-chloro-2-(2-methylphenyl)imino-1,3-thiazol-5-ylidene]methyl]-3-methyl-4-oxophthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCOC1=CC(=O)/C(=C\NNC(=O)C2=NN(C=C2O)C3=CC=CC=C3)/C=C1

DOS

IR

Vibrations