Geometry & MOs

Info

ID:	310578
PubChem CID:	126582788
Reduced:	O2C5H7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	429.222784
ΔH_f, kcal/mol:	-168.61
Dipole, Da:	3.83
IP(EA), eV:	-9.93(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(4,4-difluorocyclohexyl)-3-[(2R)-1-methoxypropan-2-yl]benzimidazol-5-yl]-1,3-dimethylpyridin-2-one

Drug info:

PubChemData

Smile

C1C2CC(CC1C(=O)O)(COC2)C=O

DOS

IR

Vibrations