Geometry & MOs

Info

ID:	418118
PubChem CID:	135103606
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	353.114234
ΔH_f, kcal/mol:	-50.34
Dipole, Da:	2.92
IP(EA), eV:	-9.06(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-chloro-4-[[2-hydroxyethyl(1H-imidazol-2-ylmethyl)amino]methyl]phenoxy]propanoic acid

Drug info:

PubChemData

Smile

CCCCN1CCN(CC1)C2=NOC(=C2C(=O)O)C3=CC=CC=C3

DOS

IR

Vibrations