Geometry & MOs

Info

ID:	367561
PubChem CID:	127324940
Reduced:	ON6C18H26 (1)
Stoich.:	AB6C18D26 (1)
Weight, g/mol:	399.22704
ΔH_f, kcal/mol:	26.94
Dipole, Da:	3.66
IP(EA), eV:	-8.36(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-7-[4-(4-methylcyclohexyl)piperazine-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)C(=O)CC3=NN4C=CC=NC4=N3

DOS

IR

Vibrations