Geometry & MOs

Info

ID:	27832
PubChem CID:	823782
Reduced:	SN2O2C12H14 (1)
Stoich.:	AB2C2D12E14 (1)
Weight, g/mol:	287.061614
ΔH_f, kcal/mol:	-61.71
Dipole, Da:	5.98
IP(EA), eV:	-9.0(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-hydroxy-1-methyl-3-(2-oxo-2-thiophen-2-ylethyl)indol-2-one

Drug info:

PubChemData

Smile

CCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)C

DOS

IR

Vibrations