Geometry & MOs

Info

ID:	196799
PubChem CID:	78880053
Reduced:	ClON6C22H27 (1)
Stoich.:	ABC6D22E27 (1)
Weight, g/mol:	411.089831
ΔH_f, kcal/mol:	40.38
Dipole, Da:	2.37
IP(EA), eV:	-8.79(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-[6-(4-fluorophenoxy)pyridin-3-yl]urea

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2=NNC(=C2)C(=O)N3CCN(CC3)C(C)C4=CC=CC=C4Cl

DOS

IR

Vibrations