Geometry & MOs

Info

ID:	361204
PubChem CID:	127302159
Reduced:	O3N4C20H26 (1)
Stoich.:	A3B4C20D26 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-67.45
Dipole, Da:	7.79
IP(EA), eV:	-8.64(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-1-(1-methyl-4-oxocinnoline-3-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)N3CCC(CC3)CN4CCOCC4

DOS

IR

Vibrations