Geometry & MOs

Info

ID:	225362
PubChem CID:	85756514
Reduced:	ON4C12H14 (1)
Stoich.:	AB4C12D14 (1)
Weight, g/mol:	318.103814
ΔH_f, kcal/mol:	62.93
Dipole, Da:	8.83
IP(EA), eV:	-8.98(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethoxyphenyl)-3-(3-methylsulfanylphenyl)urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC3C(=NN=NC3=O)C=C2

DOS

IR

Vibrations