Geometry & MOs

Info

ID:	1697
PubChem CID:	4888
Reduced:	NO3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	255.089543
ΔH_f, kcal/mol:	-73.26
Dipole, Da:	3.01
IP(EA), eV:	-9.13(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)O

DOS

IR

Vibrations