Geometry & MOs

Info

ID:	21339
PubChem CID:	587962
Reduced:	SO2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	254.134051
ΔH_f, kcal/mol:	-104.15
Dipole, Da:	6.81
IP(EA), eV:	-9.74(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nonylthiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCCC1=CC=C(S1)C(=O)O

DOS

IR

Vibrations