Geometry & MOs

Info

ID:	26913
PubChem CID:	804376
Reduced:	N2O6H12C17 (1)
Stoich.:	A2B6C12D17 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-106.51
Dipole, Da:	9.73
IP(EA), eV:	-10.19(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-1-(2-phenylacetyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations