Geometry & MOs

Info

ID:

370538

PubChem CID:

127339551

Reduced:

F2N2S2O5C14H18 (1)

Stoich.:

A2B2C2D5E14F18 (1)

Weight, g/mol:

293.108565

ΔHf, kcal/mol:

-276.29

Dipole, Da:

0.84

IP(EA), eV:

-10.32(-1.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-4-yl-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCS1(=O)=O)C(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations