Geometry & MOs

Info

ID:	30155
PubChem CID:	840341
Reduced:	OSN2H16C18 (1)
Stoich.:	ABC2D16E18 (1)
Weight, g/mol:	306.080297
ΔH_f, kcal/mol:	32.49
Dipole, Da:	2.88
IP(EA), eV:	-9.05(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[4-[(2,2,2-trifluoroacetyl)amino]cyclohexyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCC(=O)NC2=NC(=CS2)C3=CC=CC=C3

DOS

IR

Vibrations