Geometry & MOs

Info

ID:	367917
PubChem CID:	127326090
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	325.19026
ΔH_f, kcal/mol:	15.02
Dipole, Da:	8.75
IP(EA), eV:	-8.94(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-1-phenylpiperidin-2-one

Drug info:

PubChemData

Smile

CCN1C=NN=C1C2CCN(CC2)C3CCCN(C3=O)C4=CC=CC=C4

DOS

IR

Vibrations