Geometry & MOs

Info

ID:	26227
PubChem CID:	641417
Reduced:	O3H14C16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	166.09938
ΔH_f, kcal/mol:	2.89
Dipole, Da:	3.6
IP(EA), eV:	-9.8(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(ethoxymethoxy)-3-methylbenzene

Drug info:

PubChemData

Smile

COC(=O)C#CCCCC(=O)C#CC1=CC=CC=C1

DOS

IR

Vibrations