Geometry & MOs

Info

ID:	261707
PubChem CID:	103246639
Reduced:	ON2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	310.135114
ΔH_f, kcal/mol:	-50.74
Dipole, Da:	6.81
IP(EA), eV:	-9.07(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[1-(5-methylthiophen-2-yl)ethylamino]acetyl]piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CCN2CCC(C2C1)NCC3=NC=NC=C3C(=O)O

DOS

IR

Vibrations