Geometry & MOs

Info

ID:	282133
PubChem CID:	103916644
Reduced:	BrOF3N3C12H13 (1)
Stoich.:	ABC3D3E12F13 (1)
Weight, g/mol:	330.01162
ΔH_f, kcal/mol:	-170.55
Dipole, Da:	4.07
IP(EA), eV:	-9.38(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-N-(2-methyl-3H-benzimidazol-5-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC(F)(F)F)C(=O)C2=NC(=CC=C2)Br

DOS

IR

Vibrations