Geometry & MOs

Info

ID:	264933
PubChem CID:	103504229
Reduced:	FSO2N4C13H15 (1)
Stoich.:	ABC2D4E13F15 (1)
Weight, g/mol:	313.126026
ΔH_f, kcal/mol:	-58.43
Dipole, Da:	3.42
IP(EA), eV:	-9.01(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(6-fluoro-2,3-dihydroindol-1-yl)sulfonyl]piperidin-3-yl]methanamine

Drug info:

PubChemData

Smile

CNCC1=C(NN=C1)S(=O)(=O)N2CCC3=C2C=C(C=C3)F

DOS

IR

Vibrations