Geometry & MOs

Info

ID:	208474
PubChem CID:	80533484
Reduced:	ClSBr2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	414.9428
ΔH_f, kcal/mol:	1.99
Dipole, Da:	2.77
IP(EA), eV:	-9.4(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4,5-dibromothiophen-2-yl)-(2,3-dihydro-1H-inden-5-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

C1CCCC(CC1)C(C2=CC(=C(S2)Br)Cl)Br

DOS

IR

Vibrations