Geometry & MOs

Info

ID:	36690
PubChem CID:	8011199
Reduced:	NO2F3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	357.157623
ΔH_f, kcal/mol:	-238.48
Dipole, Da:	4.0
IP(EA), eV:	-9.9(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[benzyl(methyl)amino]-1-oxopropan-2-yl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)C2=CC=C(C=C2)OC(F)(F)F

DOS

IR

Vibrations