Geometry & MOs

Info

ID:	407011
PubChem CID:	135079127
Reduced:	BrO3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	542.18518
ΔH_f, kcal/mol:	-101.41
Dipole, Da:	2.01
IP(EA), eV:	-9.63(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-2-bromo-9-[tert-butyl(diphenyl)silyl]oxy-6-ethylidenenon-2-enoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)OC(C=C)C1=CC=C(C=C1)Br

DOS

IR

Vibrations