Geometry & MOs

Info

ID:	277235
PubChem CID:	103827404
Reduced:	N2O2C19H38 (1)
Stoich.:	A2B2C19D38 (1)
Weight, g/mol:	291.071842
ΔH_f, kcal/mol:	-168.23
Dipole, Da:	1.84
IP(EA), eV:	-8.81(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[2-(2,2,2-trifluoroethoxy)acetyl]amino]benzoic acid

Drug info:

PubChemData

Smile

CC(C)CCCCNC(C)CC1CCCN1C(=O)OC(C)(C)C

DOS

IR

Vibrations