Geometry & MOs

Info

ID:	137306
PubChem CID:	52186461
Reduced:	SF3N3O4C17H20 (1)
Stoich.:	AB3C3D4E17F20 (1)
Weight, g/mol:	358.249452
ΔH_f, kcal/mol:	-310.02
Dipole, Da:	6.28
IP(EA), eV:	-9.55(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(1S)-2-[[2,6-di(propan-2-yl)phenyl]carbamoylamino]-1-(furan-2-yl)ethyl]-dimethylazanium

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@H]1C(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3C(F)(F)F

DOS

IR

Vibrations