Geometry & MOs

Info

ID:	328240
PubChem CID:	126700345
Reduced:	BrON2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	532.324748
ΔH_f, kcal/mol:	63.03
Dipole, Da:	7.72
IP(EA), eV:	-8.62(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-bis[3-(2-methoxyethoxy)-2-(2-methoxyethoxymethyl)propoxy]-4-methylbenzene

Drug info:

PubChemData

Smile

CC1=NC2=C3N1CCCCOC3=CC(=C2)Br

DOS

IR

Vibrations