Geometry & MOs

Info

ID:	323356
PubChem CID:	126674500
Reduced:	O2C11H22 (1)
Stoich.:	A2B11C22 (1)
Weight, g/mol:	514.059946
ΔH_f, kcal/mol:	-135.69
Dipole, Da:	0.84
IP(EA), eV:	-10.09(2.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis[2-chloro-5-(4-cyanophenoxy)phenyl]urea

Drug info:

PubChemData

Smile

CCC1(CC(C1(O)O)(CC)CC)C

DOS

IR

Vibrations