Geometry & MOs

Info

ID:	145505
PubChem CID:	53536502
Reduced:	N5H19C21 (1)
Stoich.:	A5B19C21 (1)
Weight, g/mol:	484.279804
ΔH_f, kcal/mol:	146.14
Dipole, Da:	5.19
IP(EA), eV:	-8.85(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-4-(2,4-dioxo-7-propan-2-yl-1-propylpyrido[2,3-d]pyrimidine-5-carbonyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)C2=CC=CC=C2)C3=NC(=CN=C3)N4C=CC=N4

DOS

IR

Vibrations