Geometry & MOs

Info

ID:	138665
PubChem CID:	52403732
Reduced:	Cl2O2N3C17H21 (1)
Stoich.:	A2B2C3D17E21 (1)
Weight, g/mol:	369.238947
ΔH_f, kcal/mol:	-73.3
Dipole, Da:	7.63
IP(EA), eV:	-9.0(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2R)-2-hydroxy-3-[2-methoxy-5-[[(2-methoxy-2-oxoethyl)-methylamino]methyl]phenoxy]propyl]-methyl-propan-2-ylazanium

Drug info:

PubChemData

Smile

C[C@@]1(CC1(Cl)Cl)C(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCCCC3

DOS

IR

Vibrations