Geometry & MOs

Info

ID:	5456
PubChem CID:	13180
Reduced:	BrC2H3 (2)
Stoich.:	AB2C3 (2)
Weight, g/mol:	213.88158
ΔH_f, kcal/mol:	4.48
Dipole, Da:	0.0
IP(EA), eV:	-10.19(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dibromobut-2-ene

Drug info:

PubChemData

Smile

C(C=CCBr)Br

DOS

IR

Vibrations