Geometry & MOs

Info

ID:	128827
PubChem CID:	51060040
Reduced:	N4O5C23H26 (1)
Stoich.:	A4B5C23D26 (1)
Weight, g/mol:	468.03208
ΔH_f, kcal/mol:	-82.96
Dipole, Da:	6.75
IP(EA), eV:	-8.41(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-bromo-2-[(E)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl] 4-methylbenzoate

Drug info:

PubChemData

Smile

CCCCCOC1=CC=C(C=C1)C2=NNC(=O)C=C2NN/C=C/3\C=C(C(=O)C(=C3)OC)O

DOS

IR

Vibrations