Geometry & MOs

Info

ID:	406517
PubChem CID:	135077950
Reduced:	NOSF3C13H16 (1)
Stoich.:	ABCD3E13F16 (1)
Weight, g/mol:	307.085384
ΔH_f, kcal/mol:	-171.79
Dipole, Da:	2.58
IP(EA), eV:	-8.59(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE,R)-2-methyl-N-[2,2,2-trifluoro-1-(4-methoxyphenyl)ethylidene]propane-2-sulfinamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C(=N\[S@](=O)C(C)(C)C)/C(F)(F)F

DOS

IR

Vibrations