Geometry & MOs

Info

ID:	22930
PubChem CID:	600017
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	289.204179
ΔH_f, kcal/mol:	-104.97
Dipole, Da:	0.51
IP(EA), eV:	-8.77(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-phenyl-3-piperidin-1-ylpropanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations