Geometry & MOs

Info

ID:	184119
PubChem CID:	77113037
Reduced:	N3C8H13 (1)
Stoich.:	A3B8C13 (1)
Weight, g/mol:	204.064726
ΔH_f, kcal/mol:	39.95
Dipole, Da:	5.48
IP(EA), eV:	-8.74(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methylidene-2-(3-methylimidazol-4-yl)-1H-pyrimidine-4,6-dione

Drug info:

PubChemData

Smile

CN1C=NC=C1C=CCCN

DOS

IR

Vibrations