Geometry & MOs

Info

ID:	25826
PubChem CID:	631302
Reduced:	SF3O5H7C14 (1)
Stoich.:	AB3C5D7E14 (1)
Weight, g/mol:	386.13068
ΔH_f, kcal/mol:	-293.85
Dipole, Da:	7.97
IP(EA), eV:	-9.59(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10-acenaphthylen-1-ylphenanthren-9-yl) acetate

Drug info:

PubChemData

Smile

COC(=O)C(=C1OC2=C(S1)C(=O)OC3=CC=CC=C32)C(F)(F)F

DOS

IR

Vibrations