Geometry & MOs

Info

ID:	302669
PubChem CID:	124391893
Reduced:	N3O5H13C19 (1)
Stoich.:	A3B5C13D19 (1)
Weight, g/mol:	468.96763
ΔH_f, kcal/mol:	35.12
Dipole, Da:	4.16
IP(EA), eV:	-9.09(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-bromo-6-chloro-4-[(E)-[[2-(2-nitrophenyl)acetyl]hydrazinylidene]methyl]phenoxy]acetic acid

Drug info:

PubChemData

Smile

C#CCOC1=C(C=CC=C1[N+](=O)[O-])/C=C\2/C(=O)NN(C2=O)C3=CC=CC=C3

DOS

IR

Vibrations