Geometry & MOs

Info

ID:	142639
PubChem CID:	53070503
Reduced:	O3N4C24H28 (1)
Stoich.:	A3B4C24D28 (1)
Weight, g/mol:	340.189926
ΔH_f, kcal/mol:	-45.36
Dipole, Da:	6.7
IP(EA), eV:	-8.37(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-ethylphenyl)-6-oxopyridazin-3-yl]-N-methylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCC(CC3)C(=O)NCC4=CC=C(O4)C

DOS

IR

Vibrations