Geometry & MOs

Info

ID:	166567
PubChem CID:	74710902
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	413.220223
ΔH_f, kcal/mol:	-87.89
Dipole, Da:	3.0
IP(EA), eV:	-9.71(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2C(C1)CC(NC2=O)C(=O)NCC3=CC=CC=C3

DOS

IR

Vibrations