Geometry & MOs

Info

ID:	322291
PubChem CID:	126669615
Reduced:	NOH15C16 (2)
Stoich.:	ABC15D16 (2)
Weight, g/mol:	454.262028
ΔH_f, kcal/mol:	-10.99
Dipole, Da:	3.09
IP(EA), eV:	-8.46(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethylbenzoyl)-2-phenyl-N-(3-propan-2-ylphenyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](C(N(C1)C(=O)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4)C(=O)NC5=CC6=C(CCC6)C=C5

DOS

IR

Vibrations