Geometry & MOs

Info

ID:	375362
PubChem CID:	131500086
Reduced:	NSF3C10H10 (1)
Stoich.:	ABC3D10E10 (1)
Weight, g/mol:	213.09652
ΔH_f, kcal/mol:	-125.06
Dipole, Da:	3.32
IP(EA), eV:	-9.57(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(5,7-difluoro-2,3-dihydro-1-benzofuran-6-yl)propan-1-amine

Drug info:

PubChemData

Smile

C1CN[C@H]1C2=CC=C(C=C2)SC(F)(F)F

DOS

IR

Vibrations