Geometry & MOs

Info

ID:	364857
PubChem CID:	127316306
Reduced:	SO2N3C22H25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	-27.29
Dipole, Da:	6.06
IP(EA), eV:	-8.87(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(4-ethyl-1,3-thiazol-2-yl)piperidine-1-carbonyl]-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CCC1=CSC(=N1)C2CCCN(C2)C(=O)C3=C(N=C4C=C(C=CC4=C3)OC)C

DOS

IR

Vibrations