Geometry & MOs

Info

ID:	208677
PubChem CID:	80565157
Reduced:	OSN3H11C12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	28.73
Dipole, Da:	4.73
IP(EA), eV:	-8.94(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxolan-2-ylmethyl)-2,3-dihydroindole-3-carboxylic acid

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2N1)C(=O)NC3=NC=CS3

DOS

IR

Vibrations