Geometry & MOs

Info

ID:	240599
PubChem CID:	93616685
Reduced:	SN2O3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	270.103814
ΔH_f, kcal/mol:	-137.39
Dipole, Da:	4.1
IP(EA), eV:	-9.12(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-butan-2-yl]-3-(2-methylsulfonylphenyl)urea

Drug info:

PubChemData

Smile

C[C@@H](C(C)C)NC(=O)NC1=CC=CC=C1S(=O)(=O)C

DOS

IR

Vibrations