Geometry & MOs

Info

ID:	193359
PubChem CID:	78381105
Reduced:	F2N5O5C18H20 (1)
Stoich.:	A2B5C5D18E20 (1)
Weight, g/mol:	561.266128
ΔH_f, kcal/mol:	-184.44
Dipole, Da:	6.11
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.792565
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[4-[4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-phenylbutyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CNC1=[N+](C=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)OCC4=C(C=C(C=C4)F)F

DOS

IR

Vibrations