Geometry & MOs

Info

ID:	14672
PubChem CID:	417272
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	289.204179
ΔH_f, kcal/mol:	-99.83
Dipole, Da:	0.78
IP(EA), eV:	-8.81(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-2-yl 3-phenyl-3-piperidin-1-ylpropanoate

Drug info:

PubChemData

Smile

CCC(C)OC(=O)CC(C1=CC=CC=C1)N2CCCCC2

DOS

IR

Vibrations