Geometry & MOs

Info

ID:	208486
PubChem CID:	80535032
Reduced:	OSBr2H8C12 (1)
Stoich.:	ABC2D8E12 (1)
Weight, g/mol:	394.9741
ΔH_f, kcal/mol:	19.55
Dipole, Da:	3.35
IP(EA), eV:	-9.5(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-cyclopentyl-1-(4,5-dibromothiophen-2-yl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C(=O)C2=C(C=CS2)Br

DOS

IR

Vibrations