Geometry & MOs

Info

ID:	361219
PubChem CID:	127302174
Reduced:	SO3N4C19H24 (1)
Stoich.:	AB3C4D19E24 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-59.74
Dipole, Da:	7.4
IP(EA), eV:	-8.34(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)NCC3(CCSC3)N4CCOCC4

DOS

IR

Vibrations