Geometry & MOs

Info

ID:	361213
PubChem CID:	127302168
Reduced:	O2N5C20H23 (1)
Stoich.:	A2B5C20D23 (1)
Weight, g/mol:	353.148789
ΔH_f, kcal/mol:	3.71
Dipole, Da:	4.71
IP(EA), eV:	-8.48(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carbonyl]cinnolin-4-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)NC3=NNC(=C3)CC4CCCCC4

DOS

IR

Vibrations