Geometry & MOs

Info

ID:	223345
PubChem CID:	85334894
Reduced:	N2O2C9H12 (1)
Stoich.:	A2B2C9D12 (1)
Weight, g/mol:	178.074228
ΔH_f, kcal/mol:	-57.91
Dipole, Da:	4.04
IP(EA), eV:	-10.24(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylcyclopropyl)-5-methylidene-1H-pyrimidine-4,6-dione

Drug info:

PubChemData

Smile

CCC1C(=O)NC(=NC1=O)C2CC2

DOS

IR

Vibrations