Geometry & MOs

Info

ID:	326217
PubChem CID:	126687183
Reduced:	ClFON6C17H22 (1)
Stoich.:	ABCD6E17F22 (1)
Weight, g/mol:	254.199428
ΔH_f, kcal/mol:	12.33
Dipole, Da:	4.32
IP(EA), eV:	-8.37(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-(methoxymethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](CN(C1)O)CNC2=C(C=NC(N2)C3=CN[C@H]4C3=CC(=CN4)Cl)F

DOS

IR

Vibrations