Geometry & MOs

Info

ID:	367429
PubChem CID:	127324607
Reduced:	O2N6C21H28 (1)
Stoich.:	A2B6C21D28 (1)
Weight, g/mol:	346.24811
ΔH_f, kcal/mol:	-37.54
Dipole, Da:	4.03
IP(EA), eV:	-9.38(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-pyrrolidin-1-ylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations