Geometry & MOs

Info

ID:	11261
PubChem CID:	112625
Reduced:	ClC5H7 (1)
Stoich.:	AB5C7 (1)
Weight, g/mol:	102.023628
ΔH_f, kcal/mol:	29.75
Dipole, Da:	2.46
IP(EA), eV:	-10.63(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-methylbut-1-yne

Drug info:

PubChemData

Smile

CC(CCl)C#C

DOS

IR

Vibrations