Geometry & MOs

Info

ID:	371379
PubChem CID:	127346056
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	390.157957
ΔH_f, kcal/mol:	-148.09
Dipole, Da:	3.87
IP(EA), eV:	-9.28(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(11-azatricyclo[6.2.1.02,7]undeca-2,4,6-triene-11-carbonyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCC1CCCCCN1C(=O)C2COCCO2

DOS

IR

Vibrations