Geometry & MOs

Info

ID:	30129
PubChem CID:	840205
Reduced:	FNOSCl3H9C10 (1)
Stoich.:	ABCDE3F9G10 (1)
Weight, g/mol:	314.945446
ΔH_f, kcal/mol:	-82.67
Dipole, Da:	2.78
IP(EA), eV:	-9.39(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[(1S)-2,2,2-trichloro-1-phenylsulfanylethyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S[C@H](C(Cl)(Cl)Cl)NC(=O)CF

DOS

IR

Vibrations