Geometry & MOs

Info

ID:	299951
PubChem CID:	118043405
Reduced:	O3N4C17H24 (1)
Stoich.:	A3B4C17D24 (1)
Weight, g/mol:	454.329439
ΔH_f, kcal/mol:	-55.85
Dipole, Da:	2.46
IP(EA), eV:	-8.98(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis[2-(2-hexoxyethoxy)ethoxy]benzene

Drug info:

PubChemData

Smile

CCC(C)(C)OC(=O)N(CC)C1=CN(N=C1C)C2=C[N+](=CC=C2)[O-]

DOS

IR

Vibrations