Geometry & MOs

Info

ID:	136009
PubChem CID:	51964499
Reduced:	O2S2F3N4C17H17 (1)
Stoich.:	A2B2C3D4E17F17 (1)
Weight, g/mol:	417.040131
ΔH_f, kcal/mol:	-156.15
Dipole, Da:	8.43
IP(EA), eV:	-9.51(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[3-[(2R)-2-thiophen-3-ylpyrrolidine-1-carbonyl]phenyl]-thiophen-2-ylsulfonylazanide

Drug info:

PubChemData

Smile

C[C@H](C(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2C(F)(F)F)SC3=NN=CS3

DOS

IR

Vibrations