Geometry & MOs

Info

ID:	177649
PubChem CID:	76208409
Reduced:	Cl2O2N3C11H13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	285.088019
ΔH_f, kcal/mol:	-44.2
Dipole, Da:	5.17
IP(EA), eV:	-9.11(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-4-hydroxyiminobutyl)-5-chloro-2-methoxybenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)C(=O)NCCCC(=NO)N)Cl

DOS

IR

Vibrations