Geometry & MOs

Info

ID:	385585
PubChem CID:	134979483
Reduced:	BrSO2H17C18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	436.243372
ΔH_f, kcal/mol:	-9.16
Dipole, Da:	4.83
IP(EA), eV:	-9.64(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(2S)-5-[tert-butyl(diphenyl)silyl]oxy-2-methylpentyl]-2,3-dihydropyran-6-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C/C=C/S(=O)(=O)/C=C/CC2=CC=C(C=C2)Br

DOS

IR

Vibrations