Geometry & MOs

Info

ID:	404718
PubChem CID:	135069936
Reduced:	OC15H24 (1)
Stoich.:	AB15C24 (1)
Weight, g/mol:	518.164185
ΔH_f, kcal/mol:	-70.89
Dipole, Da:	4.89
IP(EA), eV:	-9.72(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(N-benzoyl-4-methoxyanilino)-6-(4-fluorophenyl)pyridin-3-yl] benzoate

Drug info:

PubChemData

Smile

CCCCCCC1=CC(=O)[C@H]2[C@@H]1CCCC2

DOS

IR

Vibrations