Geometry & MOs

Info

ID:	345291
PubChem CID:	127269525
Reduced:	N3O4C17H21 (1)
Stoich.:	A3B4C17D21 (1)
Weight, g/mol:	366.180424
ΔH_f, kcal/mol:	-151.1
Dipole, Da:	5.71
IP(EA), eV:	-8.35(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-oxopyrrolidin-1-yl)phenyl]-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)NC4CCCNC4=O

DOS

IR

Vibrations