Geometry & MOs

Info

ID:	424151
PubChem CID:	135121512
Reduced:	NO8C14H15 (1)
Stoich.:	AB8C14D15 (1)
Weight, g/mol:	318.25588
ΔH_f, kcal/mol:	-301.18
Dipole, Da:	6.27
IP(EA), eV:	-9.33(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-pentadec-5-enyl]benzene-1,4-diol

Drug info:

PubChemData

Smile

C1=CC(=C(C2=C1C=C(C(=O)O2)C(=O)NC(CO)(CO)CO)O)O

DOS

IR

Vibrations