Geometry & MOs

Info

ID:	357803
PubChem CID:	127294646
Reduced:	F2S2N3O3C15H19 (1)
Stoich.:	A2B2C3D3E15F19 (1)
Weight, g/mol:	377.144299
ΔH_f, kcal/mol:	-200.22
Dipole, Da:	4.16
IP(EA), eV:	-8.64(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-1-(oxolan-3-ylmethyl)-3-(2-thiomorpholin-4-ylsulfonylethyl)urea

Drug info:

PubChemData

Smile

C1CN(C2=C1C(=CC(=C2)F)F)C(=O)NCCS(=O)(=O)N3CCSCC3

DOS

IR

Vibrations