Geometry & MOs

Info

ID:	362593
PubChem CID:	127308364
Reduced:	O3N6C20H24 (1)
Stoich.:	A3B6C20D24 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	-19.06
Dipole, Da:	4.38
IP(EA), eV:	-8.43(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyquinolin-6-yl)-3-(4-methylpyrazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C(C)N2CCN(CC2)C(=O)NC3=CC4=C(C=C3)N=C(C=C4)OC

DOS

IR

Vibrations