Geometry & MOs

Info

ID:	187734
PubChem CID:	77616576
Reduced:	ClON2F4H17C18 (1)
Stoich.:	ABC2D4E17F18 (1)
Weight, g/mol:	374.186652
ΔH_f, kcal/mol:	-219.55
Dipole, Da:	5.07
IP(EA), eV:	-10.1(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-fluoro-4-[4-(methylamino)piperidin-1-yl]phenyl]-4-methyl-5-(triazol-1-yl)-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1C2C(C(C(C1F)Cl)CC3=CC=C(C=C3)C(F)(F)F)NCC(C2=O)C#N

DOS

IR

Vibrations