Geometry & MOs

Info

ID:	46753
PubChem CID:	10526961
Reduced:	SO2N5C23H27 (1)
Stoich.:	AB2C5D23E27 (1)
Weight, g/mol:	438.181567
ΔH_f, kcal/mol:	3.34
Dipole, Da:	4.15
IP(EA), eV:	-8.31(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(5S)-3-[4-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CN1C=CC2=C1C(=O)CCN(C2=O)CCCN3CCN(CC3)C4=NSC5=CC=CC=C54

DOS

IR

Vibrations