Geometry & MOs

Info

ID:	73544
PubChem CID:	48418083
Reduced:	FO2N3C22H22 (1)
Stoich.:	AB2C3D22E22 (1)
Weight, g/mol:	405.18009
ΔH_f, kcal/mol:	-52.13
Dipole, Da:	4.72
IP(EA), eV:	-8.84(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(2,3-dihydroindol-1-yl)propanoyl]-3-ethyl-4-oxophthalazine-1-carbohydrazide

Drug info:

PubChemData

Smile

COC1=NC(=CC2=CC=CC=C21)C(=O)N3CCN(CC3)CC4=CC=CC=C4F

DOS

IR

Vibrations