Geometry & MOs

Info

ID:	168633
PubChem CID:	74997705
Reduced:	N3O6C17H21 (1)
Stoich.:	A3B6C17D21 (1)
Weight, g/mol:	386.206918
ΔH_f, kcal/mol:	-238.11
Dipole, Da:	8.1
IP(EA), eV:	-9.47(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;6-[2-(cyclohexylmethyl)-4,6-dimethylphenoxy]-3,5-dihydroxyhexanoate

Drug info:

PubChemData

Smile

CC(C(=O)N1C(CNC1=O)C(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations