Geometry & MOs

Info

ID:	168384
PubChem CID:	74960069
Reduced:	O3C12H20 (1)
Stoich.:	A3B12C20 (1)
Weight, g/mol:	530.06936
ΔH_f, kcal/mol:	-151.36
Dipole, Da:	1.66
IP(EA), eV:	-9.72(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[3-[5-(3aH-benzimidazol-2-yl)thiophen-2-yl]-2-benzothiophen-1-yl]thiophen-2-yl]-1H-benzimidazole

Drug info:

PubChemData

Smile

CC1(OCC(O1)C2CC=CCC2CO)C

DOS

IR

Vibrations