Geometry & MOs

Info

ID:	126980
PubChem CID:	50986500
Reduced:	N3O3C12H23 (1)
Stoich.:	A3B3C12D23 (1)
Weight, g/mol:	285.118793
ΔH_f, kcal/mol:	-161.7
Dipole, Da:	4.74
IP(EA), eV:	-9.24(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(trifluoromethyl)pentanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCC(=O)N1CCNCC1

DOS

IR

Vibrations