Geometry & MOs

Info

ID:	304524
PubChem CID:	124756157
Reduced:	N4O5H16C20 (1)
Stoich.:	A4B5C16D20 (1)
Weight, g/mol:	352.215078
ΔH_f, kcal/mol:	-28.23
Dipole, Da:	7.69
IP(EA), eV:	-9.52(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C(=O)[C@H]3[C@H]4C=C[C@]([C@H]3C2=O)(O4)CNC5=NC=C(C=C5)[N+](=O)[O-]

DOS

IR

Vibrations