Geometry & MOs

Info

ID:	88606
PubChem CID:	49955682
Reduced:	ClNO3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	380.126963
ΔH_f, kcal/mol:	-121.5
Dipole, Da:	3.57
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.752360
Charge, e:	-2

Chem-info

IUPAC name:

2-[2-methoxy-4-[(2-morpholin-4-ylethylamino)methyl]phenoxy]ethanol;dichloride

Drug info:

PubChemData

Smile

COCCNCC1=CC=C(C=C1)OCCO.[Cl-]

DOS

IR

Vibrations