Geometry & MOs

Info

ID:	135519
PubChem CID:	51884913
Reduced:	Cl2S2N3O3C17H19 (1)
Stoich.:	A2B2C3D3E17F19 (1)
Weight, g/mol:	256.097368
ΔH_f, kcal/mol:	-83.43
Dipole, Da:	5.2
IP(EA), eV:	-8.73(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)NC(=O)[C@@H](CCSC)NS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations