Geometry & MOs

Info

ID:	179398
PubChem CID:	76476443
Reduced:	NO3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	458.171396
ΔH_f, kcal/mol:	-133.91
Dipole, Da:	2.43
IP(EA), eV:	-8.51(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[3-fluoro-4-[3-(5-nitropyridin-2-yl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

COC(=O)C(C(CC1CCCCC1)NC2=CC=CC=C2)O

DOS

IR

Vibrations