Geometry & MOs

Info

ID:	430694
PubChem CID:	135170760
Reduced:	NO4C13H13 (1)
Stoich.:	AB4C13D13 (1)
Weight, g/mol:	192.93746
ΔH_f, kcal/mol:	-117.25
Dipole, Da:	4.29
IP(EA), eV:	-9.69(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1,2-dihydroxy-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CN1C(C(=CC1=O)C2=CC=CC=C2)OC(=O)OC

DOS

IR

Vibrations