Geometry & MOs

Info

ID:	394131
PubChem CID:	135022401
Reduced:	Br2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	391.98096
ΔH_f, kcal/mol:	-44.68
Dipole, Da:	1.65
IP(EA), eV:	-9.37(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[C@@H]1[C@H](C/C=C\C[C@H]2[C@@H](O1)C[C@H](O2)C=C=CBr)Br

DOS

IR

Vibrations