Geometry & MOs

Info

ID:	69557
PubChem CID:	47193737
Reduced:	ION3H12C15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	383.01307
ΔH_f, kcal/mol:	51.34
Dipole, Da:	7.61
IP(EA), eV:	-8.97(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodophenyl)-3-[(2-methoxypyridin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C#N)CNC(=O)NC2=CC=C(C=C2)I

DOS

IR

Vibrations