Geometry & MOs

Info

ID:	434307
PubChem CID:	135174664
Reduced:	ON2C11H14 (1)
Stoich.:	AB2C11D14 (1)
Weight, g/mol:	576.319937
ΔH_f, kcal/mol:	-17.68
Dipole, Da:	2.19
IP(EA), eV:	-9.58(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-[[2-(2-methylpropanoyl)-1-benzofuran-5-yl]oxy]propylamino]-1-[5-[2-(propan-2-ylamino)ethoxy]-1-benzofuran-2-yl]hexan-1-one

Drug info:

PubChemData

Smile

CCCCN1CC2=C(C1=O)C=CC=N2

DOS

IR

Vibrations