Geometry & MOs

Info

ID:

343400

PubChem CID:

127266573

Reduced:

O2F3N3C14H18 (1)

Stoich.:

A2B3C3D14E18 (1)

Weight, g/mol:

235.056861

ΔHf, kcal/mol:

-216.4

Dipole, Da:

4.99

IP(EA), eV:

-10.01(-1.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-methyl-2-[4-(trifluoromethyl)pyrimidin-2-yl]oxyacetamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)COC2=NC=CC(=N2)C(F)(F)F

DOS

IR

Vibrations