Geometry & MOs

Info

ID:

130799

PubChem CID:

51108437

Reduced:

SF2O2N3H13C15 (1)

Stoich.:

AB2C2D3E13F15 (1)

Weight, g/mol:

223.077933

ΔHf, kcal/mol:

-119.17

Dipole, Da:

4.99

IP(EA), eV:

-9.03(-0.88)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-methyl-2-(1-thiophen-2-ylethylamino)-4H-imidazol-5-one

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=N2)NC(=O)CNC(=O)C3=CC(=CC(=C3)F)F

DOS

IR

Vibrations