Geometry & MOs

Info

ID:	279596
PubChem CID:	103844433
Reduced:	ON3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	270.169191
ΔH_f, kcal/mol:	-2.69
Dipole, Da:	7.78
IP(EA), eV:	-9.02(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-5-[[2-ethyl-2-(hydroxymethyl)butyl]amino]-1-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCC(CC)(CNC1=CN=C(C=C1)C#N)CO

DOS

IR

Vibrations