Geometry & MOs

Info

ID:	16668
PubChem CID:	474614
Reduced:	N2O5C20H26 (1)
Stoich.:	A2B5C20D26 (1)
Weight, g/mol:	374.184172
ΔH_f, kcal/mol:	-196.5
Dipole, Da:	6.49
IP(EA), eV:	-9.6(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2,2-bis(hydroxymethyl)cyclopropyl]methyl]-6-(3,5-dimethylphenoxy)-5-ethylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCC1=C(N(C(=O)NC1=O)CC2CC2(CO)CO)OC3=CC(=CC(=C3)C)C

DOS

IR

Vibrations