Geometry & MOs

Info

ID:	193376
PubChem CID:	78384525
Reduced:	O5C15H18 (1)
Stoich.:	A5B15C18 (1)
Weight, g/mol:	266.151809
ΔH_f, kcal/mol:	-194.45
Dipole, Da:	4.09
IP(EA), eV:	-9.42(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dihydroxy-6-methylhept-3-en-2-yl)-5-methylbenzene-1,4-diol

Drug info:

PubChemData

Smile

CC1(CC(C(O1)C(=O)OC)C(=O)OC)C2=CC=CC=C2

DOS

IR

Vibrations