Geometry & MOs

Info

ID:	373976
PubChem CID:	131321936
Reduced:	NO2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	352.93157
ΔH_f, kcal/mol:	-79.59
Dipole, Da:	1.66
IP(EA), eV:	-8.65(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-amino-6-chloro-7-iodo-2,3-dihydrochromene-4-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC2=C(CC(CC2)N)C(=C1)O

DOS

IR

Vibrations