Geometry & MOs

Info

ID:	272735
PubChem CID:	103753759
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	280.189926
ΔH_f, kcal/mol:	37.5
Dipole, Da:	8.91
IP(EA), eV:	-8.82(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-1-ethyl-5-[(1-methylcyclohexyl)methylamino]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1(CCCCC1)CNC2=CN=C(C=C2)C#N

DOS

IR

Vibrations