Geometry & MOs

Info

ID:	374365
PubChem CID:	131327456
Reduced:	BrOSN3C10H10 (1)
Stoich.:	ABCD3E10F10 (1)
Weight, g/mol:	270.97565
ΔH_f, kcal/mol:	51.88
Dipole, Da:	2.79
IP(EA), eV:	-9.14(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-7-fluoro-1-methylbenzimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CN=S(=O)(C)C1=NC=NC2=C1C=C(C=C2)Br

DOS

IR

Vibrations