Geometry & MOs

Info

ID:	52427
PubChem CID:	12015288
Reduced:	SO2N5H25C32 (1)
Stoich.:	AB2C5D25E32 (1)
Weight, g/mol:	385.97246
ΔH_f, kcal/mol:	93.97
Dipole, Da:	2.8
IP(EA), eV:	-8.11(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromophenyl)-1-phenylthieno[2,3-d]imidazole-2,6-dione

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2C(=C(SC3=C2N(C(=O)N3C4=CC=C(C=C4)NC5=CC=CC=C5)C6=CC=CC=C6)N)C#N

DOS

IR

Vibrations