Geometry & MOs

Info

ID:	354522
PubChem CID:	127287136
Reduced:	ON6C16H26 (1)
Stoich.:	AB6C16D26 (1)
Weight, g/mol:	389.290309
ΔH_f, kcal/mol:	-18.35
Dipole, Da:	1.27
IP(EA), eV:	-8.94(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2,5-dimethylpyrrolidin-1-yl)ethyl]-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)N3CCN4CCCCC4C3

DOS

IR

Vibrations