Geometry & MOs

Info

ID:	36721
PubChem CID:	8011800
Reduced:	SN2O6C19H22 (1)
Stoich.:	AB2C6D19E22 (1)
Weight, g/mol:	355.178358
ΔH_f, kcal/mol:	-216.16
Dipole, Da:	4.4
IP(EA), eV:	-8.71(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N)OCC

DOS

IR

Vibrations