Geometry & MOs

Info

ID:	310944
PubChem CID:	126588576
Reduced:	ClNO4C18H20 (1)
Stoich.:	ABC4D18E20 (1)
Weight, g/mol:	441.0437
ΔH_f, kcal/mol:	-113.86
Dipole, Da:	3.28
IP(EA), eV:	-8.48(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[2-[(4-ethyl-2-methylphenoxy)methyl]-4-iodophenyl]-N-hydroxycarbamate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC(=C2)Cl)N(C(=O)OC)O)C

DOS

IR

Vibrations