Geometry & MOs

Info

ID:	373917
PubChem CID:	131321273
Reduced:	BrNOF2C11H14 (1)
Stoich.:	ABCD2E11F14 (1)
Weight, g/mol:	280.05751
ΔH_f, kcal/mol:	-128.9
Dipole, Da:	0.73
IP(EA), eV:	-9.52(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-1H-indol-3-yl)-3-methylbutan-1-amine

Drug info:

PubChemData

Smile

CC(C)CC(C1=CC(=C(C(=C1O)F)F)Br)N

DOS

IR

Vibrations