Geometry & MOs

Info

ID:	395559
PubChem CID:	135025811
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	693.377786
ΔH_f, kcal/mol:	-64.11
Dipole, Da:	3.28
IP(EA), eV:	-9.21(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[3-[1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]oxy-5-[(2R)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]oxyphenoxy]-N-(2,4,6-trimethylphenyl)propanamide

Drug info:

PubChemData

Smile

C1CC2(COC1)C3=CC=CC=C3CO2

DOS

IR

Vibrations