Geometry & MOs

Info

ID:	261560
PubChem CID:	103240316
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	231.147058
ΔH_f, kcal/mol:	-109.57
Dipole, Da:	5.19
IP(EA), eV:	-9.75(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3-methoxy-3-oxopropyl)amino]hexanoate

Drug info:

PubChemData

Smile

COCC1=CC=CC=C1CNCC(C(=O)O)N

DOS

IR

Vibrations