Geometry & MOs

Info

ID:	399550
PubChem CID:	135040892
Reduced:	SN2F3O3C11H17 (1)
Stoich.:	AB2C3D3E11F17 (1)
Weight, g/mol:	200.064886
ΔH_f, kcal/mol:	-270.14
Dipole, Da:	1.61
IP(EA), eV:	-9.07(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1,2-difluorobicyclo[4.1.0]hepta-2,4-diene-7-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C/C(=C(\C(F)(F)F)/N(C)N)/C(=O)SCC

DOS

IR

Vibrations