Geometry & MOs

Info

ID:	35781
PubChem CID:	7980318
Reduced:	NO4H19C21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-96.77
Dipole, Da:	4.52
IP(EA), eV:	-8.66(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-(4-piperidin-1-ylanilino)propan-2-yl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)COC3=CC=CC=C3

DOS

IR

Vibrations