Geometry & MOs

Info

ID:	214980
PubChem CID:	85083950
Reduced:	N2Br4O5H16C18 (1)
Stoich.:	A2B4C5D16E18 (1)
Weight, g/mol:	660.342169
ΔH_f, kcal/mol:	-116.28
Dipole, Da:	5.06
IP(EA), eV:	-8.82(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1Br)O)CC(=NO)C(=O)NCCC2=CC(=C(C(=C2)Br)O)Br)Br

DOS

IR

Vibrations