Geometry & MOs

Info

ID:	205437
PubChem CID:	80100790
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	-122.88
Dipole, Da:	5.56
IP(EA), eV:	-9.21(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-hydroxyphenyl)methyl]piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CNCCC1(CC2=CC(=CC=C2)O)C(=O)O

DOS

IR

Vibrations