Geometry & MOs

Info

ID:	183647
PubChem CID:	77047343
Reduced:	SO3N4H12C13 (1)
Stoich.:	AB3C4D12E13 (1)
Weight, g/mol:	249.147727
ΔH_f, kcal/mol:	-22.65
Dipole, Da:	4.4
IP(EA), eV:	-9.78(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N,N-diethyl-4-methyl-6-oxo-5H-pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

C1CN2C=NN=C2CN1C(=O)C3=C(C=CS3)C=CC(=O)O

DOS

IR

Vibrations