Geometry & MOs

Info

ID:	260888
PubChem CID:	103208309
Reduced:	SN2O2F4H10C11 (1)
Stoich.:	AB2C2D4E10F11 (1)
Weight, g/mol:	258.064983
ΔH_f, kcal/mol:	-251.4
Dipole, Da:	4.93
IP(EA), eV:	-8.87(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)C(=S)N)NC(=O)COCC(F)(F)F

DOS

IR

Vibrations