Geometry & MOs

Info

ID:	18521
PubChem CID:	542233
Reduced:	BrO2C5H8 (2)
Stoich.:	AB2C5D8 (2)
Weight, g/mol:	359.93948
ΔH_f, kcal/mol:	-180.16
Dipole, Da:	1.97
IP(EA), eV:	-9.88(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4-dibromo-5-(methoxymethoxy)hex-3-en-2-yl] acetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations