Geometry & MOs

Info

ID:	336571
PubChem CID:	127255578
Reduced:	BrO3H7C9 (1)
Stoich.:	AB3C7D9 (1)
Weight, g/mol:	160.043676
ΔH_f, kcal/mol:	-82.1
Dipole, Da:	4.4
IP(EA), eV:	-9.33(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-1H-indole-6-carbonitrile

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=O)COC2=C1)Br

DOS

IR

Vibrations