Geometry & MOs

Info

ID:	270339
PubChem CID:	103636114
Reduced:	ClOSN5C12H14 (1)
Stoich.:	ABCD5E12F14 (1)
Weight, g/mol:	240.999604
ΔH_f, kcal/mol:	10.02
Dipole, Da:	6.88
IP(EA), eV:	-9.3(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[2-(trifluoromethylsulfanyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC(C)CC1=NN=C(S1)NC(=O)C2=CC(=C(N=C2)N)Cl

DOS

IR

Vibrations