Geometry & MOs

Info

ID:	192622
PubChem CID:	78292666
Reduced:	PO2N3H26C28 (1)
Stoich.:	AB2C3D26E28 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	11.48
Dipole, Da:	8.26
IP(EA), eV:	-8.78(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-5-(4-methylanilino)-8-phenyl-4a,5,6,8a-tetrahydropyrido[2,3-d]pyrimidine-2,4,7-trione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(NC(NC2=O)N=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O

DOS

IR

Vibrations