Geometry & MOs

Info

ID:	282612
PubChem CID:	103932814
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	231.110673
ΔH_f, kcal/mol:	-159.93
Dipole, Da:	6.86
IP(EA), eV:	-9.79(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-4-(2-methoxypropanoyl)-6-methylmorpholine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCOCC(=O)N1CCC2=C(C1)C=C(C=C2)C(=O)O

DOS

IR

Vibrations