Geometry & MOs

Info

ID:	149391
PubChem CID:	53789063
Reduced:	NO2Br3H10C15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	283.080435
ΔH_f, kcal/mol:	-29.92
Dipole, Da:	5.0
IP(EA), eV:	-8.97(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-aminoethylideneamino) 3,4-dimethoxy-5-nitrobenzoate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=CC(=O)O)C2=CC(=C(C(=C2)Br)N)Br)Br

DOS

IR

Vibrations