Geometry & MOs

Info

ID:	185668
PubChem CID:	77328589
Reduced:	BrN2O5C8H9 (1)
Stoich.:	AB2C5D8E9 (1)
Weight, g/mol:	371.941603
ΔH_f, kcal/mol:	-175.93
Dipole, Da:	3.3
IP(EA), eV:	-10.38(-2.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-5-(2,5,6-trichloro-1H-benzimidazol-4-yl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1C(OC(O1)CO)N2C(=O)C(C=NC2=O)Br

DOS

IR

Vibrations