Geometry & MOs

Info

ID:	312384
PubChem CID:	126604537
Reduced:	NOC17H19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	540.409815
ΔH_f, kcal/mol:	5.15
Dipole, Da:	3.66
IP(EA), eV:	-8.05(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-1,5-bis[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propylamino]pentane-1,5-diol

Drug info:

PubChemData

Smile

CC1=CC2=C(CN(C3=CC=CCC3(C2=O)C)C)C=C1

DOS

IR

Vibrations