Geometry & MOs

Info

ID:	9968
PubChem CID:	95576
Reduced:	BrO2C4H7 (1)
Stoich.:	AB2C4D7 (1)
Weight, g/mol:	165.96294
ΔH_f, kcal/mol:	-95.21
Dipole, Da:	2.0
IP(EA), eV:	-10.8(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-bromopropanoate

Drug info:

PubChemData

Smile

CC(C(=O)OC)Br

DOS

IR

Vibrations