Geometry & MOs

Info

ID:	38432
PubChem CID:	8050952
Reduced:	FSO2N3C17H24 (1)
Stoich.:	ABC2D3E17F24 (1)
Weight, g/mol:	284.212673
ΔH_f, kcal/mol:	-133.7
Dipole, Da:	5.06
IP(EA), eV:	-9.23(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

cyclohexyl-[[1-[(2-methylphenyl)methyl]imidazol-2-yl]methyl]azanium

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)N(C)CCN1[C@@H](SCC1=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations