Geometry & MOs

Info

ID:	221298
PubChem CID:	85267543
Reduced:	BrO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	393.194008
ΔH_f, kcal/mol:	-129.18
Dipole, Da:	1.58
IP(EA), eV:	-9.69(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-3-(7-hydroxy-4-methyl-5-phenylhept-2-enoyl)-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1C(C(OC(O1)CC2=CC=CC=C2Br)CO)OCC3=CC=CC=C3

DOS

IR

Vibrations