Geometry & MOs

Info

ID:	35480
PubChem CID:	7979930
Reduced:	N4O4C21H22 (1)
Stoich.:	A4B4C21D22 (1)
Weight, g/mol:	370.083268
ΔH_f, kcal/mol:	-76.1
Dipole, Da:	2.49
IP(EA), eV:	-8.76(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-chlorobenzoyl)-3-ethyl-4-oxophthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCCOC3=CC=CC=C3

DOS

IR

Vibrations