Geometry & MOs

Info

ID:	210825
PubChem CID:	80858751
Reduced:	ON2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	327.09462
ΔH_f, kcal/mol:	-48.49
Dipole, Da:	1.61
IP(EA), eV:	-9.47(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-ethyl-4-(2-ethylcyclohexyl)oxypyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)OC1=NC(=NC(=N1)OC)NC

DOS

IR

Vibrations