Geometry & MOs

Info

ID:	369137
PubChem CID:	127331369
Reduced:	FO2N3H22C23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-55.87
Dipole, Da:	8.38
IP(EA), eV:	-8.65(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-cyclopentyloxypiperidine-1-carbonyl)-1-ethylcinnolin-4-one

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=O)C(=N1)C(=O)N3CC4(CCCC4)C5=C3C=CC=C5F

DOS

IR

Vibrations