Geometry & MOs

Info

ID:	38796
PubChem CID:	8137936
Reduced:	SCl2O3N4H12C14 (1)
Stoich.:	AB2C3D4E12F14 (1)
Weight, g/mol:	380.044296
ΔH_f, kcal/mol:	-66.85
Dipole, Da:	2.97
IP(EA), eV:	-9.32(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,5-dichloro-6-oxopyridazin-1-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NC(=O)CN2C(=O)C(=C(C=N2)Cl)Cl)SCC(=O)N

DOS

IR

Vibrations