Geometry & MOs

Info

ID:	350169
PubChem CID:	127277247
Reduced:	SO2N4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	370.146347
ΔH_f, kcal/mol:	-60.52
Dipole, Da:	5.58
IP(EA), eV:	-8.79(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-[4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1,3-thiazol-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN1C(=O)NC2=NC(=CS2)CN3CCOCC3

DOS

IR

Vibrations