Geometry & MOs

Info

ID:	370855
PubChem CID:	127341121
Reduced:	ON5C21H31 (1)
Stoich.:	AB5C21D31 (1)
Weight, g/mol:	369.252861
ΔH_f, kcal/mol:	-4.15
Dipole, Da:	8.0
IP(EA), eV:	-8.76(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(4-methylcyclohexyl)-2-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCN(C1CCCCC1)C(=O)CN2CCCC(C2)C3=NN=C4N3C=CC=C4

DOS

IR

Vibrations