Geometry & MOs

Info

ID:	355420
PubChem CID:	127288483
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-95.32
Dipole, Da:	6.2
IP(EA), eV:	-8.82(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[3-(1,2,4-triazol-1-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)CNC(=O)CC3CCCC3

DOS

IR

Vibrations