Geometry & MOs

Info

ID:	25328
PubChem CID:	623097
Reduced:	NBr2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	362.24571
ΔH_f, kcal/mol:	-73.52
Dipole, Da:	3.96
IP(EA), eV:	-9.3(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=C(N1)C)C(=CBr)Br)C

DOS

IR

Vibrations