Geometry & MOs

Info

ID:	82710
PubChem CID:	49856378
Reduced:	FN2O4C14H17 (1)
Stoich.:	AB2C4D14E17 (1)
Weight, g/mol:	216.106277
ΔH_f, kcal/mol:	-183.76
Dipole, Da:	3.17
IP(EA), eV:	-8.9(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-fluoro-1H-indol-3-yl)pentanenitrile

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1F)C(=CN2)CCCCN.C(=O)(C(=O)O)O

DOS

IR

Vibrations