Geometry & MOs

Info

ID:	441415
PubChem CID:	135234578
Reduced:	N3O3C22H23 (1)
Stoich.:	A3B3C22D23 (1)
Weight, g/mol:	271.120843
ΔH_f, kcal/mol:	-12.96
Dipole, Da:	8.44
IP(EA), eV:	-8.77(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-5-phenyl-3-[(Z)-prop-1-enyl]-1,3,3a,6a-tetrahydrofuro[3,4-c]pyrrole-4,6-dione

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)COC2=C(C=CC(=C2)OC(C)C)C3=CC=CC4=NC=CN43

DOS

IR

Vibrations