Geometry & MOs

Info

ID:	224224
PubChem CID:	85340242
Reduced:	O3H7C10 (2)
Stoich.:	A3B7C10 (2)
Weight, g/mol:	360.080473
ΔH_f, kcal/mol:	-170.81
Dipole, Da:	1.85
IP(EA), eV:	-9.03(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-fluoro-4-[2-oxo-5-[(thiatriazol-5-ylamino)methyl]-1,3-oxazolidin-3-yl]phenyl]cyclopropane-1-carbonitrile

Drug info:

PubChemData

Smile

C1CC23C4=C(C=CC(=C4C1O)O)OC5(O2)C=CC(=O)C6=C5C(=CC=C6)O3

DOS

IR

Vibrations