Geometry & MOs

Info

ID:	196642
PubChem CID:	78857611
Reduced:	O3N5C16H19 (1)
Stoich.:	A3B5C16D19 (1)
Weight, g/mol:	354.169191
ΔH_f, kcal/mol:	-46.91
Dipole, Da:	5.07
IP(EA), eV:	-9.04(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-1-[2-(4-methyl-1-oxophthalazin-2-yl)acetyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CN2C(=O)N3C=CC=CC3=N2)C(=O)NC4CC4

DOS

IR

Vibrations