Geometry & MOs

Info

ID:	16920
PubChem CID:	479919
Reduced:	ClNBr2O3H6C14 (1)
Stoich.:	ABC2D3E6F14 (1)
Weight, g/mol:	430.83825
ΔH_f, kcal/mol:	-60.15
Dipole, Da:	2.8
IP(EA), eV:	-9.84(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dibromo-3-(3-chlorophenyl)-1,3-benzoxazine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)N2C(=O)C3=C(C(=CC(=C3)Br)Br)OC2=O

DOS

IR

Vibrations