Geometry & MOs

Info

ID:	183287
PubChem CID:	77001493
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	-93.95
Dipole, Da:	4.03
IP(EA), eV:	-9.32(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylbutyl)-5-propyl-1H-pyrimidine-4,6-dione

Drug info:

PubChemData

Smile

CCCC1C(NC(NC1=O)CC2=CC=CC(=C2)C)O

DOS

IR

Vibrations