Geometry & MOs

Info

ID:	209127
PubChem CID:	80627753
Reduced:	BrFNSC15H21 (1)
Stoich.:	ABCDE15F21 (1)
Weight, g/mol:	227.170771
ΔH_f, kcal/mol:	-46.03
Dipole, Da:	5.2
IP(EA), eV:	-8.63(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[cyclopentyl(thiolan-2-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC1=C(C=C(C=C1)F)Br)C2CCCS2

DOS

IR

Vibrations