Geometry & MOs

Info

ID:	310617
PubChem CID:	126583892
Reduced:	NC8H13 (1)
Stoich.:	AB8C13 (1)
Weight, g/mol:	263.098
ΔH_f, kcal/mol:	35.2
Dipole, Da:	0.6
IP(EA), eV:	-8.12(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,2-dimethyl-4-methylsulfanylindol-3-yl)propanoic acid

Drug info:

PubChemData

Smile

C/C(=C\C=C)/N(C)C=C

DOS

IR

Vibrations