Geometry & MOs

Info

ID:	328933
PubChem CID:	126729324
Reduced:	OSN3H25C36 (1)
Stoich.:	ABC3D25E36 (1)
Weight, g/mol:	618.25588
ΔH_f, kcal/mol:	132.71
Dipole, Da:	3.48
IP(EA), eV:	-8.29(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7-dimethyl-9-(3-methyl-10-naphthalen-1-yl-3,4-dihydroanthracen-9-yl)-[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)C6=CC=C(C=C6)C7=NC=NC(=N7)C8=CC=CC=C8)C

DOS

IR

Vibrations