Geometry & MOs

Info

ID:	183379
PubChem CID:	77014171
Reduced:	OSN2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	287.101839
ΔH_f, kcal/mol:	13.56
Dipole, Da:	5.18
IP(EA), eV:	-8.56(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxophthalazin-5-yl)-3-methylpyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(CNCC1C=C2C=CC=CC2=NC1=O)CSC

DOS

IR

Vibrations