Geometry & MOs

Info

ID:	12578
PubChem CID:	140789
Reduced:	C3H5 (2)
Stoich.:	A3B5 (2)
Weight, g/mol:	82.07825
ΔH_f, kcal/mol:	24.99
Dipole, Da:	0.31
IP(EA), eV:	-9.98(2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylpent-2-yne

Drug info:

PubChemData

Smile

CC#CC(C)C

DOS

IR

Vibrations