Geometry & MOs

Info

ID:	286223
PubChem CID:	104162846
Reduced:	SN3O4C13H13 (1)
Stoich.:	AB3C4D13E13 (1)
Weight, g/mol:	296.083078
ΔH_f, kcal/mol:	-107.6
Dipole, Da:	6.56
IP(EA), eV:	-8.97(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-pyrrolidin-1-ylsulfonyl-2,3-dihydroindole-6-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=NN1)S(=O)(=O)N2CCC3=C2C=C(C=C3)C(=O)O

DOS

IR

Vibrations