Geometry & MOs

Info

ID:	436378
PubChem CID:	135199566
Reduced:	ClNO3C17H20 (1)
Stoich.:	ABC3D17E20 (1)
Weight, g/mol:	556.26857
ΔH_f, kcal/mol:	-36.49
Dipole, Da:	5.95
IP(EA), eV:	-9.6(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3',6'-bis(dimethylamino)-N-(6-formamidohexyl)-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)OC#CCNCl)O

DOS

IR

Vibrations