Geometry & MOs

Info

ID:	53555
PubChem CID:	14716622
Reduced:	OCl3C14F25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	490.283158
ΔH_f, kcal/mol:	-1285.31
Dipole, Da:	0.87
IP(EA), eV:	-11.63(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-[(3-dodecyl-2,5-dioxopyrrolidin-1-yl)-phenylmethylidene]amino] benzoate

Drug info:

PubChemData

Smile

C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(Cl)Cl)Cl

DOS

IR

Vibrations