Geometry & MOs

Info

ID:	323466
PubChem CID:	126674905
Reduced:	O2N6C15H22 (1)
Stoich.:	A2B6C15D22 (1)
Weight, g/mol:	482.119047
ΔH_f, kcal/mol:	-43.32
Dipole, Da:	3.24
IP(EA), eV:	-8.43(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C(=O)NC)NC(=O)C1=C(N=CC(=C1)/C(=C/N)/C=NC)N

DOS

IR

Vibrations