Geometry & MOs

Info

ID:	285077
PubChem CID:	104096609
Reduced:	N3O3C8H13 (1)
Stoich.:	A3B3C8D13 (1)
Weight, g/mol:	295.141973
ΔH_f, kcal/mol:	-76.73
Dipole, Da:	6.32
IP(EA), eV:	-10.26(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[3-(4-methoxypentanoylamino)phenoxy]acetate

Drug info:

PubChemData

Smile

CC(CN1C=NC(=N1)C(=O)OC)OC

DOS

IR

Vibrations