Geometry & MOs

Info

ID:	409623
PubChem CID:	135082405
Reduced:	SN2O4C10H10 (1)
Stoich.:	AB2C4D10E10 (1)
Weight, g/mol:	268.051778
ΔH_f, kcal/mol:	-120.49
Dipole, Da:	4.91
IP(EA), eV:	-10.45(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-1-(4-methylphenyl)sulfonyl-3-(oxomethylidene)urea

Drug info:

PubChemData

Smile

CCN(C(=O)N=C=O)S(=O)(=O)C1=CC=CC=C1

DOS

IR

Vibrations