Geometry & MOs

Info

ID:	328895
PubChem CID:	126728901
Reduced:	ClOSH15C21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	492.20893
ΔH_f, kcal/mol:	17.65
Dipole, Da:	2.79
IP(EA), eV:	-8.34(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-[1]benzofuro[3,2-c]xanthene

Drug info:

PubChemData

Smile

CC1(C2=C(C3=C(C=C2)C4=CC=CC=C4S3)OC5=C1C=C(C=C5)Cl)C

DOS

IR

Vibrations