Geometry & MOs

Info

ID:	362623
PubChem CID:	127308891
Reduced:	ON4C19H24 (1)
Stoich.:	AB4C19D24 (1)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	3.84
Dipole, Da:	6.04
IP(EA), eV:	-9.01(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(4-methylpyrazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C(CCC2)NC(=O)NCC3CCC4=CC=CC=C34

DOS

IR

Vibrations