Geometry & MOs

Info

ID:	70891
PubChem CID:	48414006
Reduced:	ON3C9H10 (2)
Stoich.:	AB3C9D10 (2)
Weight, g/mol:	311.138225
ΔH_f, kcal/mol:	4.23
Dipole, Da:	5.42
IP(EA), eV:	-9.55(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methyl-1-oxophthalazin-2-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC=C(C=C2)C(=O)NCC3=C(NN=C3)C

DOS

IR

Vibrations