Geometry & MOs

Info

ID:	18408
PubChem CID:	540538
Reduced:	N2F3O3C15H19 (1)
Stoich.:	A2B3C3D15E19 (1)
Weight, g/mol:	332.134777
ΔH_f, kcal/mol:	-281.3
Dipole, Da:	7.58
IP(EA), eV:	-9.11(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-acetamido-2-(2,4-dimethylanilino)-3,3,3-trifluoropropanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(F)(F)F)(NC1=C(C=C(C=C1)C)C)NC(=O)C

DOS

IR

Vibrations