Geometry & MOs

Info

ID:	354528
PubChem CID:	127287142
Reduced:	ON5C19H21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	346.24811
ΔH_f, kcal/mol:	28.71
Dipole, Da:	3.18
IP(EA), eV:	-9.04(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)NCC3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations