Geometry & MOs

Info

ID:	390659
PubChem CID:	135000213
Reduced:	SN2O2H24C27 (1)
Stoich.:	AB2C2D24E27 (1)
Weight, g/mol:	400.259234
ΔH_f, kcal/mol:	45.1
Dipole, Da:	5.1
IP(EA), eV:	-8.75(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S)-1-(4-methoxyphenyl)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C(C2=CC=CC=C2)C3=CC=CC=C3)/N=C/C4=CC=CC=C4

DOS

IR

Vibrations