Geometry & MOs

Info

ID:	6367
PubChem CID:	68320
Reduced:	BrO2C5H9 (1)
Stoich.:	AB2C5D9 (1)
Weight, g/mol:	179.97859
ΔH_f, kcal/mol:	-104.62
Dipole, Da:	2.19
IP(EA), eV:	-10.77(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-bromopropanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCBr

DOS

IR

Vibrations