Geometry & MOs

Info

ID:	47926
PubChem CID:	10535862
Reduced:	O2F3C8H11 (1)
Stoich.:	A2B3C8D11 (1)
Weight, g/mol:	196.073559
ΔH_f, kcal/mol:	-249.03
Dipole, Da:	3.43
IP(EA), eV:	-10.72(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2E)-2-[(2E)-2-(2-methoxy-2-oxoethylidene)cyclobutylidene]acetate

Drug info:

PubChemData

Smile

CCOC(=O)C(CC=C)C(F)(F)F

DOS

IR

Vibrations