Geometry & MOs

Info

ID:	81066
PubChem CID:	49854309
Reduced:	O2N3C34H37 (1)
Stoich.:	A2B3C34D37 (1)
Weight, g/mol:	518.231791
ΔH_f, kcal/mol:	-7.28
Dipole, Da:	4.82
IP(EA), eV:	-8.53(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 7-methyl-2-oxo-1,5-diphenyl-4-(3-phenylpropylamino)pyrido[2,3-d]pyrimidine-6-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3)C(=NC(C2C4=CC=CC=C4)C)NCCCC5=CC=CC=C5)C

DOS

IR

Vibrations