Geometry & MOs

Info

ID:	371178
PubChem CID:	127344010
Reduced:	O2N3C20H31 (1)
Stoich.:	A2B3C20D31 (1)
Weight, g/mol:	395.268511
ΔH_f, kcal/mol:	-85.17
Dipole, Da:	4.22
IP(EA), eV:	-9.0(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-4-(1H-pyrazol-5-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(CNC(=O)NCC2(CCC2)O)C3=CC=CC=C3

DOS

IR

Vibrations