Geometry & MOs

Info

ID:	140824
PubChem CID:	52767759
Reduced:	ClFSN2O2C15H20 (1)
Stoich.:	ABCD2E2F15G20 (1)
Weight, g/mol:	343.262363
ΔH_f, kcal/mol:	-117.99
Dipole, Da:	4.27
IP(EA), eV:	-8.74(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexyl-N-[(2-piperidin-1-ylpyridin-3-yl)methyl]butanamide

Drug info:

PubChemData

Smile

C1CCN(C1)C[C@H]2CCCN2S(=O)(=O)C3=C(C=C(C=C3)Cl)F

DOS

IR

Vibrations