Geometry & MOs

Info

ID:	448363
PubChem CID:	135290392
Reduced:	FC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	517.237685
ΔH_f, kcal/mol:	-127.76
Dipole, Da:	3.03
IP(EA), eV:	-10.72(1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl]-[4-[1-(2-methoxyethyl)benzimidazol-2-yl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCCC1(CC1C(F)F)CCC

DOS

IR

Vibrations