Geometry & MOs

Info

ID:	223618
PubChem CID:	85335316
Reduced:	SF2O5N6C17H20 (1)
Stoich.:	AB2C5D6E17F20 (1)
Weight, g/mol:	458.17879
ΔH_f, kcal/mol:	-170.55
Dipole, Da:	4.77
IP(EA), eV:	-9.35(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[3-fluoro-4-[6-[methyl(thiophen-3-ylmethyl)amino]-3-azabicyclo[3.1.0]hexan-3-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)OC2=C(C=C(C=C2F)S(=O)(=O)NC(CCCN=C(N)N)C(=O)NO)F

DOS

IR

Vibrations