Geometry & MOs

Info

ID:	9679
PubChem CID:	92253
Reduced:	ON2C18H28 (1)
Stoich.:	AB2C18D28 (1)
Weight, g/mol:	288.220164
ΔH_f, kcal/mol:	-61.41
Dipole, Da:	3.66
IP(EA), eV:	-8.76(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCN1CCCC[C@H]1C(=O)NC2=C(C=CC=C2C)C

DOS

IR

Vibrations