Geometry & MOs

Info

ID:	263448
PubChem CID:	103368615
Reduced:	OSF3N3C10H18 (1)
Stoich.:	ABC3D3E10F18 (1)
Weight, g/mol:	237.054753
ΔH_f, kcal/mol:	-209.72
Dipole, Da:	3.64
IP(EA), eV:	-9.18(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-[(2-methylimidazol-1-yl)methyl]propanethioamide

Drug info:

PubChemData

Smile

CCCNC(=O)CN(C)CC(C(=S)N)C(F)(F)F

DOS

IR

Vibrations