Geometry & MOs

Info

ID:	6095
PubChem CID:	66961
Reduced:	ClIH2C3 (1)
Stoich.:	ABC2D3 (1)
Weight, g/mol:	199.88897
ΔH_f, kcal/mol:	59.69
Dipole, Da:	1.72
IP(EA), eV:	-10.05(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-1-iodoprop-1-yne

Drug info:

PubChemData

Smile

C(C#CI)Cl

DOS

IR

Vibrations