Geometry & MOs

Info

ID:	260839
PubChem CID:	103206639
Reduced:	F3O3H13C15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	298.112899
ΔH_f, kcal/mol:	-231.17
Dipole, Da:	2.34
IP(EA), eV:	-8.74(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(2,2-difluoroethoxy)propanoyl]-1,3-dimethylbenzimidazol-2-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C=C(C=C2)C(=O)COCC(F)(F)F

DOS

IR

Vibrations