Geometry & MOs

Info

ID:	312623
PubChem CID:	126606849
Reduced:	O5C18H28 (1)
Stoich.:	A5B18C28 (1)
Weight, g/mol:	212.08373
ΔH_f, kcal/mol:	-177.41
Dipole, Da:	4.77
IP(EA), eV:	-8.74(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-3,4-dihydroxanthen-9-one

Drug info:

PubChemData

Smile

CC(=C)C(=C1CCC1)OCCOCCOCCOC(=O)C(=C)C

DOS

IR

Vibrations