Geometry & MOs

Info

ID:	181279
PubChem CID:	76727520
Reduced:	ON3C7H11 (1)
Stoich.:	AB3C7D11 (1)
Weight, g/mol:	460.247441
ΔH_f, kcal/mol:	26.86
Dipole, Da:	6.71
IP(EA), eV:	-8.54(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-13-[3-(ethylamino)propyl]-15-methyl-10-phenyl-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),3,5-tetraene-12,14-dione

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C=CN(C)C

DOS

IR

Vibrations