Geometry & MOs

Info

ID:	207582
PubChem CID:	80421160
Reduced:	BrNO3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	233.126323
ΔH_f, kcal/mol:	-110.34
Dipole, Da:	6.45
IP(EA), eV:	-8.41(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2-hydroxyethoxy)ethyl]morpholin-3-yl]acetic acid

Drug info:

PubChemData

Smile

C1COCC(N1CC2=CC=CC=C2Br)CC(=O)O

DOS

IR

Vibrations