Geometry & MOs

Info

ID:	147516
PubChem CID:	53787172
Reduced:	N2O7C14H20 (1)
Stoich.:	A2B7C14D20 (1)
Weight, g/mol:	278.97563
ΔH_f, kcal/mol:	-307.04
Dipole, Da:	6.92
IP(EA), eV:	-10.22(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(iodoamino)ethyl]benzene-1,2-diol

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C(=O)N(C(=O)CCC=O)C(=O)CCC(=O)O

DOS

IR

Vibrations