Geometry & MOs

Info

ID:	10668
PubChem CID:	106465
Reduced:	ClO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	256.123008
ΔH_f, kcal/mol:	-95.72
Dipole, Da:	1.79
IP(EA), eV:	-8.39(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dibutoxy-2-chlorobenzene

Drug info:

PubChemData

Smile

CCCCOC1=CC(=C(C=C1)OCCCC)Cl

DOS

IR

Vibrations