Geometry & MOs

Info

ID:	449959
PubChem CID:	135302821
Reduced:	OC27H34 (1)
Stoich.:	AB27C34 (1)
Weight, g/mol:	498.414506
ΔH_f, kcal/mol:	-41.8
Dipole, Da:	1.1
IP(EA), eV:	-8.49(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(tert-butylamino)-N-[2-[1-[2-[3-(tert-butylamino)propanoylamino]ethoxy]cyclohexyl]oxyethyl]hexanamide

Drug info:

PubChemData

Smile

CCCC(CC)C1=CC2=CC(=C(C=C2C=C1)C3=CC=C(C=C3)C(CC)CC)O

DOS

IR

Vibrations