Geometry & MOs

Info

ID:	391434
PubChem CID:	135005028
Reduced:	NO2H7C10 (1)
Stoich.:	AB2C7D10 (1)
Weight, g/mol:	282.02554
ΔH_f, kcal/mol:	-10.08
Dipole, Da:	1.98
IP(EA), eV:	-9.48(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3,7-dimethyltricyclo[5.4.0.02,9]undec-3-ene-5,8-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC=COC2=O

DOS

IR

Vibrations