Geometry & MOs

Info

ID:	168748
PubChem CID:	75014132
Reduced:	N2O2C9H13 (2)
Stoich.:	A2B2C9D13 (2)
Weight, g/mol:	444.039597
ΔH_f, kcal/mol:	-132.89
Dipole, Da:	2.94
IP(EA), eV:	-8.58(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[3-fluoro-4-[5-(methylsulfonylmethyl)-1,3,4-thiadiazol-2-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide

Drug info:

PubChemData

Smile

CC(=O)NNCC1CN(C(=O)O1)C2=CC=C(C=C2)OCCN3CCCC3

DOS

IR

Vibrations