Geometry & MOs

Info

ID:	35897
PubChem CID:	7980463
Reduced:	FNO3H16C17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	394.040815
ΔH_f, kcal/mol:	-132.09
Dipole, Da:	1.29
IP(EA), eV:	-9.75(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-fluorophenyl)methyl 1-chloro-9,10-dioxoanthracene-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)CNC(=O)CC2=CC=CC=C2F

DOS

IR

Vibrations