Geometry & MOs

Info

ID:	165167
PubChem CID:	74510170
Reduced:	N3O5C23H29 (1)
Stoich.:	A3B5C23D29 (1)
Weight, g/mol:	368.246378
ΔH_f, kcal/mol:	-156.88
Dipole, Da:	16.7
IP(EA), eV:	-9.52(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylcyclohexyl)-1-(3-phenylprop-2-enoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)[O-])[NH3+]

DOS

IR

Vibrations