Geometry & MOs

Info

ID:	394740
PubChem CID:	135023667
Reduced:	NO4H23C24 (1)
Stoich.:	AB4C23D24 (1)
Weight, g/mol:	333.03644
ΔH_f, kcal/mol:	-57.37
Dipole, Da:	2.15
IP(EA), eV:	-9.31(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-2-benzyl-4-bromo-3-phenyl-1,2-oxazolidin-5-ol

Drug info:

PubChemData

Smile

CO[C@@H]1[C@H]([C@H](N(O1)CC2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations