Geometry & MOs

Info

ID:	280908
PubChem CID:	103851872
Reduced:	NSF4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	257.104977
ΔH_f, kcal/mol:	-197.17
Dipole, Da:	6.72
IP(EA), eV:	-8.76(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-difluorophenyl)methyl]-3-methylsulfanylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CSC1CCCC1NCC2=CC(=C(C=C2)F)C(F)(F)F

DOS

IR

Vibrations