Geometry & MOs

Info

ID:	228931
PubChem CID:	87566266
Reduced:	FSO2N3C23H26 (1)
Stoich.:	ABC2D3E23F26 (1)
Weight, g/mol:	434.054082
ΔH_f, kcal/mol:	-35.57
Dipole, Da:	2.8
IP(EA), eV:	-8.92(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	-4

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)SC\1CCN(C/C1=C\C2=NN(C=C2)C)C(C3=CC=CC=C3F)C(=O)C4CC4

DOS

IR

Vibrations