Geometry & MOs

Info

ID:	136870
PubChem CID:	52116350
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	373.065176
ΔH_f, kcal/mol:	-29.08
Dipole, Da:	3.58
IP(EA), eV:	-8.84(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3-chlorophenyl)-6-oxopyridazin-1-yl]-N-(thiophen-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CN(C)CCCNC(=O)CCN1C(=O)C=CC(=N1)C2=CC=CC=C2

DOS

IR

Vibrations