Geometry & MOs

Info

ID:	286667
PubChem CID:	104179658
Reduced:	NS2C12H25 (1)
Stoich.:	AB2C12D25 (1)
Weight, g/mol:	263.114399
ΔH_f, kcal/mol:	-30.86
Dipole, Da:	3.0
IP(EA), eV:	-8.54(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluorophenyl)-N-(2-prop-2-ynylsulfanylethyl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

CCSCCCNC1CCCCC1SC

DOS

IR

Vibrations