Geometry & MOs

Info

ID:	203241
PubChem CID:	79798406
Reduced:	ON3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	290.087827
ΔH_f, kcal/mol:	-8.5
Dipole, Da:	3.1
IP(EA), eV:	-9.85(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-methyl-2-[[methyl(phenyl)carbamoyl]amino]propanoic acid

Drug info:

PubChemData

Smile

CCC(C)(C1=NC(=NO1)C2CCCC2)N

DOS

IR

Vibrations