Geometry & MOs

Info

ID:	282452
PubChem CID:	103927872
Reduced:	N2F3O3C12H21 (1)
Stoich.:	A2B3C3D12E21 (1)
Weight, g/mol:	282.137971
ΔH_f, kcal/mol:	-325.56
Dipole, Da:	5.14
IP(EA), eV:	-10.02(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(3-fluoro-2-methylphenyl)carbamoylamino]-3,3-dimethylbutanoic acid

Drug info:

PubChemData

Smile

CCCN(CC(F)(F)F)C(=O)N[C@@H](C(=O)O)C(C)(C)C

DOS

IR

Vibrations