Geometry & MOs

Info

ID:	149727
PubChem CID:	53789402
Reduced:	O3C8H10 (2)
Stoich.:	A3B8C10 (2)
Weight, g/mol:	312.089878
ΔH_f, kcal/mol:	-216.62
Dipole, Da:	2.62
IP(EA), eV:	-9.38(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyanophenoxy)phenoxy]benzonitrile

Drug info:

PubChemData

Smile

CCCCOC(=O)C1=CC=CC=C1OC(=COC)C(=O)OC

DOS

IR

Vibrations