Geometry & MOs

Info

ID:	342988
PubChem CID:	127266151
Reduced:	NF3O5C14H14 (1)
Stoich.:	AB3C5D14E14 (1)
Weight, g/mol:	349.113707
ΔH_f, kcal/mol:	-329.72
Dipole, Da:	3.34
IP(EA), eV:	-9.83(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[3-hydroxy-2-(trifluoromethoxy)benzoyl]amino]-2-methylbutanoate

Drug info:

PubChemData

Smile

COC(=O)C1(CC1)CNC(=O)C2=C(C(=CC=C2)O)OC(F)(F)F

DOS

IR

Vibrations