Geometry & MOs

Info

ID:	292836
PubChem CID:	117360517
Reduced:	NSF2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	243.089327
ΔH_f, kcal/mol:	-92.89
Dipole, Da:	5.09
IP(EA), eV:	-9.16(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(difluoromethylsulfanyl)phenyl]cyclopentan-1-amine

Drug info:

PubChemData

Smile

C1CCC(C1)(C2=CC(=CC=C2)SC(F)F)N

DOS

IR

Vibrations