Geometry & MOs

Info

ID:	368877
PubChem CID:	127330847
Reduced:	SO2N3C19H27 (1)
Stoich.:	AB2C3D19E27 (1)
Weight, g/mol:	372.161997
ΔH_f, kcal/mol:	-77.19
Dipole, Da:	6.48
IP(EA), eV:	-8.53(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC(=CS2)CCNC(=O)C3CC4CCCC(C3)C4=O

DOS

IR

Vibrations