Geometry & MOs

Info

ID:	35506
PubChem CID:	7979961
Reduced:	N4O5H16C21 (1)
Stoich.:	A4B5C16D21 (1)
Weight, g/mol:	364.153541
ΔH_f, kcal/mol:	-87.26
Dipole, Da:	5.34
IP(EA), eV:	-9.3(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3,4-dimethylbenzoyl)-3-ethyl-4-oxophthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC4=CC=CC=C4OC3=O

DOS

IR

Vibrations