Geometry & MOs

Info

ID:	389416
PubChem CID:	134992824
Reduced:	O3C11H14 (1)
Stoich.:	A3B11C14 (1)
Weight, g/mol:	180.151415
ΔH_f, kcal/mol:	-48.26
Dipole, Da:	2.17
IP(EA), eV:	-9.44(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-dodec-3-en-7-yn-2-ol

Drug info:

PubChemData

Smile

CC1OCC(OO1)(C)C2=CC=CC=C2

DOS

IR

Vibrations