Geometry & MOs

Info

ID:	348338
PubChem CID:	127273403
Reduced:	ON3C8H12 (2)
Stoich.:	AB3C8D12 (2)
Weight, g/mol:	360.227374
ΔH_f, kcal/mol:	-20.16
Dipole, Da:	0.65
IP(EA), eV:	-9.56(-0.53)
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)-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)CCC3=NC(=NO3)C(C)(C)C

DOS

IR

Vibrations