Geometry & MOs

Info

ID:	13873
PubChem CID:	399491
Reduced:	O3H9C10 (2)
Stoich.:	A3B9C10 (2)
Weight, g/mol:	354.110338
ΔH_f, kcal/mol:	-210.34
Dipole, Da:	5.56
IP(EA), eV:	-9.08(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6-(3-methylbut-2-enyl)chromen-4-one

Drug info:

PubChemData

Smile

CC(=CCC1=C(C2=C(C=C1O)OC(=CC2=O)C3=C(C=C(C=C3)O)O)O)C

DOS

IR

Vibrations