Geometry & MOs

Info

ID:	159395
PubChem CID:	57269808
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	231.838
ΔH_f, kcal/mol:	103.7
Dipole, Da:	1.59
IP(EA), eV:	-10.02(-2.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dibromoprop-2-ene-1-thiol

Drug info:

PubChemData

Smile

C1CCC(C1)CC2(C3=NC=NC3=NC=N2)N

DOS

IR

Vibrations