Geometry & MOs

Info

ID:	403632
PubChem CID:	135061080
Reduced:	SO3C19H24 (1)
Stoich.:	AB3C19D24 (1)
Weight, g/mol:	270.20024
ΔH_f, kcal/mol:	-90.42
Dipole, Da:	6.81
IP(EA), eV:	-9.26(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (2R,3R)-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butanoate

Drug info:

PubChemData

Smile

CC(=C[C@@H]1C2=CC[C@@H](C2C(O1)(C)C)S(=O)(=O)C3=CC=CC=C3)C

DOS

IR

Vibrations