Geometry & MOs

Info

ID:	285375
PubChem CID:	104103548
Reduced:	NSO4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	265.057278
ΔH_f, kcal/mol:	-111.74
Dipole, Da:	4.4
IP(EA), eV:	-9.41(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-3-methyl-1-benzothiophen-2-yl)-(1,2-oxazolidin-2-yl)methanone

Drug info:

PubChemData

Smile

C1CN(OC1)C(=O)CCS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations