Geometry & MOs

Info

ID:	340567
PubChem CID:	127262578
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	233.141579
ΔH_f, kcal/mol:	-78.59
Dipole, Da:	1.88
IP(EA), eV:	-9.2(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(2S)-piperidin-2-yl]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)[C@H]2CCCCN2

DOS

IR

Vibrations