Geometry & MOs

Info

ID:	373284
PubChem CID:	131312682
Reduced:	SN3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	264.02621
ΔH_f, kcal/mol:	49.45
Dipole, Da:	0.62
IP(EA), eV:	-8.55(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(5-bromo-1H-indol-2-yl)but-3-en-1-amine

Drug info:

PubChemData

Smile

CN1C(=CC(=C1N)CC2=CC=CC=N2)SC

DOS

IR

Vibrations