Geometry & MOs

Info

ID:	19834
PubChem CID:	573684
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	194.13068
ΔH_f, kcal/mol:	-82.73
Dipole, Da:	1.69
IP(EA), eV:	-8.62(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dipropoxybenzene

Drug info:

PubChemData

Smile

CCCOC1=CC(=CC=C1)OCCC

DOS

IR

Vibrations