Geometry & MOs

Info

ID:	36858
PubChem CID:	8013836
Reduced:	ClNF3O3H15C18 (1)
Stoich.:	ABC3D3E15F18 (1)
Weight, g/mol:	374.136553
ΔH_f, kcal/mol:	-262.27
Dipole, Da:	5.54
IP(EA), eV:	-8.96(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-(3,4,5-trimethoxyphenyl)acetyl]oxymethyl]benzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=C(C=C1)Cl)OC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations