Geometry & MOs

Info

ID:	199286
PubChem CID:	79226479
Reduced:	OSC17H22 (1)
Stoich.:	ABC17D22 (1)
Weight, g/mol:	460.84485
ΔH_f, kcal/mol:	-31.38
Dipole, Da:	3.14
IP(EA), eV:	-8.23(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-tribromo-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)aniline

Drug info:

PubChemData

Smile

C1CC2CC1CC2(CC3CSC4=CC=CC=C34)CO

DOS

IR

Vibrations