Geometry & MOs

Info

ID:	5190
PubChem CID:	12732
Reduced:	C3H5 (2)
Stoich.:	A3B5 (2)
Weight, g/mol:	82.07825
ΔH_f, kcal/mol:	30.93
Dipole, Da:	1.18
IP(EA), eV:	-10.61(1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-1-yne

Drug info:

PubChemData

Smile

CCCCC#C

DOS

IR

Vibrations