Geometry & MOs

Info

ID:	387608
PubChem CID:	134986129
Reduced:	SO2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	195.017915
ΔH_f, kcal/mol:	-33.37
Dipole, Da:	10.43
IP(EA), eV:	-8.82(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-fluoro-2-nitropropanedioate

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C(/C)\N=S(=N)(CC)CC)/C#N

DOS

IR

Vibrations