Geometry & MOs

Info

ID:	156145
PubChem CID:	56369316
Reduced:	S2F3N3O3H12C16 (1)
Stoich.:	A2B3C3D3E12F16 (1)
Weight, g/mol:	379.262363
ΔH_f, kcal/mol:	-184.36
Dipole, Da:	6.13
IP(EA), eV:	-9.51(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[1-(2-methylpropyl)piperidin-4-yl]-1-[(2-phenylphenyl)methyl]urea

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=NC2=CC(=C(C=C2S1)F)F)NS(=O)(=O)C3=CC=CC=C3F

DOS

IR

Vibrations