Geometry & MOs

Info

ID:	27990
PubChem CID:	824664
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	182.105528
ΔH_f, kcal/mol:	-75.58
Dipole, Da:	4.11
IP(EA), eV:	-8.21(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-3-methyl-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)CNCC23CCCCC3)OC

DOS

IR

Vibrations