Geometry & MOs

Info

ID:	279770
PubChem CID:	103845114
Reduced:	ClFNSC13H17 (1)
Stoich.:	ABCDE13F17 (1)
Weight, g/mol:	245.044127
ΔH_f, kcal/mol:	-46.99
Dipole, Da:	1.31
IP(EA), eV:	-8.61(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chloro-2-fluorophenyl)methyl]thiolan-3-amine

Drug info:

PubChemData

Smile

CSC1CCC(C1)NCC2=C(C=CC(=C2)Cl)F

DOS

IR

Vibrations