Geometry & MOs

Info

ID:	382269
PubChem CID:	134973323
Reduced:	Br4O4C23H32 (1)
Stoich.:	A4B4C23D32 (1)
Weight, g/mol:	256.00025
ΔH_f, kcal/mol:	-177.39
Dipole, Da:	2.76
IP(EA), eV:	-10.04(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylselanyl-5-phenyloxolan-2-one

Drug info:

PubChemData

Smile

CCC[C@@H](C)C1=C([C@@]2([C@H]([C@@]([C@]2(C)Br)(C)Br)/C(=C(/[C@@H](C)CCC)\C(=O)OC)/Br)OC1=O)Br

DOS

IR

Vibrations