Geometry & MOs

Info

ID:	348533
PubChem CID:	127273644
Reduced:	O3N4C19H34 (1)
Stoich.:	A3B4C19D34 (1)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-156.7
Dipole, Da:	6.82
IP(EA), eV:	-9.03(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butanoyl-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CCNC(=O)N2CCCC(C2)C(=O)N3CCOCC3

DOS

IR

Vibrations