Geometry & MOs

Info

ID:	209907
PubChem CID:	80739006
Reduced:	ClOS2H13C16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	397.895
ΔH_f, kcal/mol:	10.7
Dipole, Da:	4.02
IP(EA), eV:	-8.63(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-[chloro(thieno[3,2-b]thiophen-5-yl)methyl]-1,3-dihydrobenzimidazol-2-one

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)C(C3=CC4=C(S3)C=CS4)Cl)OC1

DOS

IR

Vibrations