Geometry & MOs

Info

ID:	166568
PubChem CID:	74711220
Reduced:	NO5C24H31 (1)
Stoich.:	AB5C24D31 (1)
Weight, g/mol:	399.204573
ΔH_f, kcal/mol:	-181.44
Dipole, Da:	2.02
IP(EA), eV:	-8.71(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyethyl)-1-(4-propoxyphenyl)-4a,5,6,7,8,8a-hexahydro-1H-chromeno[2,3-c]pyrrole-3,9-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)C2C3=C(C(=O)N2CCCOC)OC4CCCCC4C3=O

DOS

IR

Vibrations