Geometry & MOs

Info

ID:	319881
PubChem CID:	126657449
Reduced:	SF3N3O3C24H38 (1)
Stoich.:	AB3C3D3E24F38 (1)
Weight, g/mol:	170.022393
ΔH_f, kcal/mol:	-295.52
Dipole, Da:	7.83
IP(EA), eV:	-8.72(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-methylsulfanylprop-1-enyl]thiophene

Drug info:

PubChemData

Smile

CC(C)(C)N1CCC(CC1)NC2=CC(=CC(=C2)CC(C)(C)N3CCOCC3)S(=O)(=O)C(F)(F)F

DOS

IR

Vibrations