Geometry & MOs

Info

ID:	223977
PubChem CID:	85336515
Reduced:	FSO2N4H19C21 (1)
Stoich.:	ABC2D4E19F21 (1)
Weight, g/mol:	414.119561
ΔH_f, kcal/mol:	3.46
Dipole, Da:	6.88
IP(EA), eV:	-9.26(-2.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[3-fluoro-4-(1-imino-1-oxo-1,3-thiazinan-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]propanethioamide

Drug info:

PubChemData

Smile

C1CN(CCC1CC2=CC=C(C=C2)F)C(=O)C(=O)NC3=CC4=NC(=S)N=C4C=C3

DOS

IR

Vibrations