Geometry & MOs

Info

ID:	347835
PubChem CID:	127272897
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	384.161997
ΔH_f, kcal/mol:	-45.48
Dipole, Da:	4.56
IP(EA), eV:	-8.61(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)N2CCC(CC2)(C)C

DOS

IR

Vibrations