Geometry & MOs

Info

ID:	223344
PubChem CID:	85334893
Reduced:	SN2O2C6H8 (1)
Stoich.:	AB2C2D6E8 (1)
Weight, g/mol:	180.089878
ΔH_f, kcal/mol:	-42.94
Dipole, Da:	1.61
IP(EA), eV:	-9.53(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-5-ethyl-1H-pyrimidine-4,6-dione

Drug info:

PubChemData

Smile

CC(C(=O)OC1=NC=CS1)N

DOS

IR

Vibrations