Geometry & MOs

Info

ID:	353847
PubChem CID:	127285487
Reduced:	S2N3O3C15H27 (1)
Stoich.:	A2B3C3D15E27 (1)
Weight, g/mol:	356.13184
ΔH_f, kcal/mol:	-143.42
Dipole, Da:	5.91
IP(EA), eV:	-8.79(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-3-(1-pyrrolidin-1-ylsulfonylpyrrolidin-3-yl)urea

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)NC2CCC(CC2)C(=O)N3CCSCC3

DOS

IR

Vibrations