Geometry & MOs

Info

ID:	323392
PubChem CID:	126674680
Reduced:	ON2C25H34 (1)
Stoich.:	AB2C25D34 (1)
Weight, g/mol:	514.059946
ΔH_f, kcal/mol:	-13.74
Dipole, Da:	1.64
IP(EA), eV:	-8.49(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]1CN(CCN1C)CC2=CC=C(C=C2)C3=CC=C(C=C3)COC4CCCC4

DOS

IR

Vibrations