Geometry & MOs

Info

ID:	149715
PubChem CID:	53789390
Reduced:	NO3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	211.064471
ΔH_f, kcal/mol:	-21.99
Dipole, Da:	5.54
IP(EA), eV:	-8.46(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-amino-6-fluoro-2,3-dihydrochromene-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=CC(=C2C=CON2)C(=O)C=C1C3=CC(=CC=C3)O

DOS

IR

Vibrations