Geometry & MOs

Info

ID:	307188
PubChem CID:	125275678
Reduced:	SF3O3N5C16H16 (1)
Stoich.:	AB3C3D5E16F16 (1)
Weight, g/mol:	369.081698
ΔH_f, kcal/mol:	-205.89
Dipole, Da:	7.62
IP(EA), eV:	-9.17(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-2-ethylsulfonyl-2H-1,3,4-thiadiazol-5-ylidene]-4-(2-methylpropoxy)benzamide

Drug info:

PubChemData

Smile

C[C@@H]1[C@H](N2C(=NC1=O)NN=C2SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F)C

DOS

IR

Vibrations