Geometry & MOs

Info

ID:	188332
PubChem CID:	77700623
Reduced:	SN2O5C13H24 (1)
Stoich.:	AB2C5D13E24 (1)
Weight, g/mol:	304.125692
ΔH_f, kcal/mol:	-219.69
Dipole, Da:	6.04
IP(EA), eV:	-9.42(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(1-fluoroethyl)-N,N,11,11-tetramethyl-7,10,12-trioxa-5-thia-3-azatricyclo[7.3.0.02,6]dodec-3-en-4-amine

Drug info:

PubChemData

Smile

CCCCOCCNC1=NC2C(C(C(OC2S1)CO)O)O

DOS

IR

Vibrations