Geometry & MOs

Info

ID:	130357
PubChem CID:	51075704
Reduced:	ON5C16H21 (1)
Stoich.:	AB5C16D21 (1)
Weight, g/mol:	260.09094
ΔH_f, kcal/mol:	25.2
Dipole, Da:	5.14
IP(EA), eV:	-9.1(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-2-oxoethyl)-N-methyl-4-oxophthalazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1NC(=O)CCN2C=NC=N2)CC3=CC=CC=C3

DOS

IR

Vibrations