Geometry & MOs

Info

ID:	188934
PubChem CID:	77787028
Reduced:	O2C17H22 (1)
Stoich.:	A2B17C22 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-69.65
Dipole, Da:	3.07
IP(EA), eV:	-8.82(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-propoxypyridin-3-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=C(C2=C(O1)C=CC(=C2)C(=CCO)C)C(C)C

DOS

IR

Vibrations