Geometry & MOs

Info

ID:	225412
PubChem CID:	85756792
Reduced:	ClO6H13C20 (1)
Stoich.:	AB6C13D20 (1)
Weight, g/mol:	285.091555
ΔH_f, kcal/mol:	24.84
Dipole, Da:	11.52
IP(EA), eV:	-9.17(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

13H-chromeno[3,2-b]xanthen-5-ium

Drug info:

PubChemData

Smile

C1C2=CC3=CC=CC=C3OC2=CC4=[O+]C5=CC=CC=C5C=C41.[O-]Cl(=O)(=O)=O

DOS

IR

Vibrations