Geometry & MOs

Info

ID:	227618
PubChem CID:	87562101
Reduced:	O2F3N3C12H14 (1)
Stoich.:	A2B3C3D12E14 (1)
Weight, g/mol:	403.967624
ΔH_f, kcal/mol:	-219.45
Dipole, Da:	5.76
IP(EA), eV:	-8.3(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;2-chloroperylene-1-sulfonate

Drug info:

PubChemData

Smile

C1CN(CC(C2=CC(=C(C=C21)N)N)O)C(=O)C(F)(F)F

DOS

IR

Vibrations