Geometry & MOs

Info

ID:

23664

PubChem CID:

605350

Reduced:

O2N3F6H7C9 (1)

Stoich.:

A2B3C6D7E9 (1)

Weight, g/mol:

303.044245

ΔHf, kcal/mol:

-350.75

Dipole, Da:

4.82

IP(EA), eV:

-10.37(-1.68)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[2-[2-(2,2,2-trifluoroacetyl)-1H-imidazol-5-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

C1=C(NC(=N1)C(=O)C(F)(F)F)CCNC(=O)C(F)(F)F

DOS

IR

Vibrations