Geometry & MOs

Info

ID:	18201
PubChem CID:	538892
Reduced:	NO9C20H25 (1)
Stoich.:	AB9C20D25 (1)
Weight, g/mol:	423.152931
ΔH_f, kcal/mol:	-394.63
Dipole, Da:	5.53
IP(EA), eV:	-8.81(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,3,4-triacetyloxy-5-(2-methylanilino)-5-oxopentyl] acetate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations