Geometry & MOs

Info

ID:	13302
PubChem CID:	225157
Reduced:	OC8H15 (2)
Stoich.:	AB8C15 (2)
Weight, g/mol:	254.22458
ΔH_f, kcal/mol:	-105.82
Dipole, Da:	2.56
IP(EA), eV:	-10.25(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,8-diethyldodec-6-yne-5,8-diol

Drug info:

PubChemData

Smile

CCCCC(CC)(C#CC(CC)(CCCC)O)O

DOS

IR

Vibrations