Geometry & MOs

Info

ID:	340494
PubChem CID:	127262505
Reduced:	NO3C19H21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	295.157229
ΔH_f, kcal/mol:	-86.89
Dipole, Da:	2.62
IP(EA), eV:	-8.51(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-methylphenyl)phenyl] piperidine-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=CC=C(C=C2)OC(=O)N3CCCCC3

DOS

IR

Vibrations