Geometry & MOs

Info

ID:	406154
PubChem CID:	135076724
Reduced:	ISSiO8C20H21 (1)
Stoich.:	ABCD8E20F21 (1)
Weight, g/mol:	310.05684
ΔH_f, kcal/mol:	-287.43
Dipole, Da:	4.84
IP(EA), eV:	-8.81(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-bromoprop-2-enoxy)-3-methylbut-3-enyl]-3-methoxybenzene

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2)OC3C(=CC(=O)O3)O[Si](C)(C)C)I

DOS

IR

Vibrations