Geometry & MOs

Info

ID:	222480
PubChem CID:	85300857
Reduced:	ClFN2O4H12C15 (1)
Stoich.:	ABC2D4E12F15 (1)
Weight, g/mol:	340.07176
ΔH_f, kcal/mol:	-130.47
Dipole, Da:	5.67
IP(EA), eV:	-9.64(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC(=O)C(=COCF)C1=CC=CC=C1OC2=CC(=NC=N2)Cl

DOS

IR

Vibrations