Geometry & MOs

Info

ID:	83388
PubChem CID:	49857532
Reduced:	ClON3H20C21 (1)
Stoich.:	ABC3D20E21 (1)
Weight, g/mol:	421.163771
ΔH_f, kcal/mol:	29.46
Dipole, Da:	4.36
IP(EA), eV:	-8.63(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethoxy-9,9-dimethyl-15-phenyl-8-oxa-13,15,17-triazatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,10-tetraene-14,16-dione

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1Cl)C2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3

DOS

IR

Vibrations