Geometry & MOs

Info

ID:	211342
PubChem CID:	80933178
Reduced:	N4C11H20 (1)
Stoich.:	A4B11C20 (1)
Weight, g/mol:	264.195011
ΔH_f, kcal/mol:	1.78
Dipole, Da:	3.73
IP(EA), eV:	-8.78(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=N1)NCC(C)C)NC

DOS

IR

Vibrations