Geometry & MOs

Info

ID:	396293
PubChem CID:	135027969
Reduced:	NO5H23C29 (1)
Stoich.:	AB5C23D29 (1)
Weight, g/mol:	308.104859
ΔH_f, kcal/mol:	-105.38
Dipole, Da:	7.73
IP(EA), eV:	-8.8(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dihydroxyphenyl)-6-methyl-3-prop-2-enylchromen-4-one

Drug info:

PubChemData

Smile

CC1=C(C(=C(N1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C4=C(C5=CC=CC=C5OC4=O)O)C(=O)C

DOS

IR

Vibrations