Geometry & MOs

Info

ID:	413447
PubChem CID:	135086396
Reduced:	ClNO2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	326.24171
ΔH_f, kcal/mol:	-30.97
Dipole, Da:	2.06
IP(EA), eV:	-9.23(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-1-cyclohexyl-2-(4-methylphenyl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

C/C(=C\C(=O)N(C)OC)/C1=CC(=CC=C1)Cl

DOS

IR

Vibrations