Geometry & MOs

Info

ID:	170246
PubChem CID:	75212048
Reduced:	N2O6C27H38 (1)
Stoich.:	A2B6C27D38 (1)
Weight, g/mol:	266.126657
ΔH_f, kcal/mol:	-277.19
Dipole, Da:	4.81
IP(EA), eV:	-8.83(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-cyclohexyl-2,6-dioxo-5H-pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1C2(CCN=C2CC(C)C)C3=CC=CC=C3N1C(=O)OC(C)(C)C)C(=O)OCC

DOS

IR

Vibrations