Geometry & MOs

Info

ID:	269572
PubChem CID:	103617998
Reduced:	NO2F4C13H15 (1)
Stoich.:	AB2C4D13E15 (1)
Weight, g/mol:	277.092578
ΔH_f, kcal/mol:	-277.73
Dipole, Da:	3.74
IP(EA), eV:	-9.56(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dihydroxy-N-propyl-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

CCCN(CC(F)(F)F)C(=O)C1=C(C=C(C=C1)OC)F

DOS

IR

Vibrations