Geometry & MOs

Info

ID:	168886
PubChem CID:	75037222
Reduced:	N3O5H13C16 (1)
Stoich.:	A3B5C13D16 (1)
Weight, g/mol:	315.085521
ΔH_f, kcal/mol:	-81.27
Dipole, Da:	3.41
IP(EA), eV:	-9.6(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-4-[[(5-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=NNC(=O)C2=CC=C(C=C2)C(=O)NO)C(=O)O

DOS

IR

Vibrations