Geometry & MOs

Info

ID:	364856
PubChem CID:	127316305
Reduced:	OSN4C18H20 (1)
Stoich.:	ABC4D18E20 (1)
Weight, g/mol:	395.166748
ΔH_f, kcal/mol:	32.61
Dipole, Da:	3.93
IP(EA), eV:	-9.09(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-ethyl-1,3-thiazol-2-yl)piperidin-1-yl]-(7-methoxy-2-methylquinolin-3-yl)methanone

Drug info:

PubChemData

Smile

CCC1=CSC(=N1)C2CCCN(C2)C(=O)C3=CC=CC4=C3NN=C4

DOS

IR

Vibrations