Geometry & MOs

Info

ID:	391085
PubChem CID:	135002704
Reduced:	NO5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	459.20055
ΔH_f, kcal/mol:	-144.93
Dipole, Da:	4.0
IP(EA), eV:	-9.39(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-[cyclohexyl-(2-ethoxy-2-oxoacetyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidine-3,4-dicarboxylate

Drug info:

PubChemData

Smile

COC(C(=C=NC1=CC=CC=C1)C(=O)OC)C(=O)OC

DOS

IR

Vibrations