Geometry & MOs

Info

ID:	413336
PubChem CID:	135086284
Reduced:	BrNSO2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	290.117904
ΔH_f, kcal/mol:	25.84
Dipole, Da:	4.33
IP(EA), eV:	-8.7(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(azidomethyl)-5-fluoroindole-1-carboxylate

Drug info:

PubChemData

Smile

CS(=O)(=O)N(C#CC1=CC=CC=C1)C2=CC=C(C=C2)Br

DOS

IR

Vibrations