Geometry & MOs

Info

ID:	418622
PubChem CID:	135106340
Reduced:	NO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	356.137222
ΔH_f, kcal/mol:	-123.92
Dipole, Da:	4.72
IP(EA), eV:	-9.22(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R)-3-hydroxy-1-(6-methyl-4-oxopyran-2-carbonyl)piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@@]12CCCN(C2)C(=O)C3=CC(=CC=C3)O

DOS

IR

Vibrations