Geometry & MOs

Info

ID:	193944
PubChem CID:	78459492
Reduced:	FNO5C21H22 (1)
Stoich.:	ABC5D21E22 (1)
Weight, g/mol:	427.201516
ΔH_f, kcal/mol:	-222.2
Dipole, Da:	4.88
IP(EA), eV:	-9.22(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

diethyl-[2-[[2-[[3-(4-methylphenyl)sulfonyl-1,3-oxazolidin-2-yl]methylamino]-2-oxoacetyl]amino]ethyl]azanium

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC=C1F)OC(=O)CCCOC2=CC=C(C=C2)C(=O)C

DOS

IR

Vibrations