Geometry & MOs

Info

ID:	446069
PubChem CID:	135272142
Reduced:	O2N3C21H31 (1)
Stoich.:	A2B3C21D31 (1)
Weight, g/mol:	369.241627
ΔH_f, kcal/mol:	-84.55
Dipole, Da:	5.58
IP(EA), eV:	-8.25(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6,8-dimethyl-4-(3-piperidin-1-ylpropylamino)quinoline-3-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)CCCNC1=C(C=NC2=C(C=C(C=C21)C)C)C(=O)OCC

DOS

IR

Vibrations