Geometry & MOs

Info

ID:	124797
PubChem CID:	50896470
Reduced:	N3O3C7H9 (1)
Stoich.:	A3B3C7D9 (1)
Weight, g/mol:	253.11365
ΔH_f, kcal/mol:	-91.04
Dipole, Da:	6.29
IP(EA), eV:	-10.34(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2,6-dimethylpiperidin-1-yl)methyl]thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(N(N=C1)CCC(=O)O)C(=O)N

DOS

IR

Vibrations