Geometry & MOs

Info

ID:	182451
PubChem CID:	76890970
Reduced:	BrON2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	379.89829
ΔH_f, kcal/mol:	21.09
Dipole, Da:	7.1
IP(EA), eV:	-9.19(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[bromo-(2-bromophenyl)methylidene]-1H-benzimidazol-2-one

Drug info:

PubChemData

Smile

CC(C)(C)C(=C1C=CC2=NC(=O)NC2=C1)Br

DOS

IR

Vibrations