Geometry & MOs

Info

ID:	196305
PubChem CID:	78808928
Reduced:	SF3N3O3C15H20 (1)
Stoich.:	AB3C3D3E15F20 (1)
Weight, g/mol:	270.125594
ΔH_f, kcal/mol:	-262.33
Dipole, Da:	5.24
IP(EA), eV:	-8.93(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethylphenyl) 3-(methoxymethyl)benzoate

Drug info:

PubChemData

Smile

CN1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(F)(F)F

DOS

IR

Vibrations