Geometry & MOs

Info

ID:	221039
PubChem CID:	85256588
Reduced:	S2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	263.94313
ΔH_f, kcal/mol:	-145.73
Dipole, Da:	4.78
IP(EA), eV:	-8.72(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-2-ethoxy-3,3,3-trifluoro-1-methylsulfanylprop-1-ene

Drug info:

PubChemData

Smile

CCSC(C(=O)C1COC(O1)(C)C)SCC

DOS

IR

Vibrations