Geometry & MOs

Info

ID:	344016
PubChem CID:	127267192
Reduced:	SO2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	346.136257
ΔH_f, kcal/mol:	-37.09
Dipole, Da:	2.36
IP(EA), eV:	-8.58(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-ethoxy-3-methylbutan-2-yl)-3-(3-fluoro-2-methylsulfonylphenyl)urea

Drug info:

PubChemData

Smile

COC1=NC=CC2=C1C=CC=C2NC(=O)N3CCSCC3

DOS

IR

Vibrations