Geometry & MOs

Info

ID:	26799
PubChem CID:	798484
Reduced:	NSO3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	297.100108
ΔH_f, kcal/mol:	-120.08
Dipole, Da:	2.93
IP(EA), eV:	-9.32(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-hydroxy-3-[2-(2-hydroxyphenyl)-2-oxoethyl]-5-methyl-1H-indol-2-one

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)OC)NC(=O)C1=CC=CS1

DOS

IR

Vibrations