Geometry & MOs

Info

ID:	285013
PubChem CID:	104090668
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	202.135765
ΔH_f, kcal/mol:	2.87
Dipole, Da:	1.4
IP(EA), eV:	-9.38(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyloct-7-yn-3-ol

Drug info:

PubChemData

Smile

C#CCCCC(CCC1=CC=CC=C1)O

DOS

IR

Vibrations