Geometry & MOs

Info

ID:	31114
PubChem CID:	854585
Reduced:	NO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	255.053158
ΔH_f, kcal/mol:	-84.46
Dipole, Da:	2.46
IP(EA), eV:	-9.42(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dihydroxy-3-pyridin-2-ylchromen-7-one

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C(=O)CC2=CC=CC=N2)O)O

DOS

IR

Vibrations