Geometry & MOs

Info

ID:	126498
PubChem CID:	50966373
Reduced:	FNOC9H10 (2)
Stoich.:	ABCD9E10 (2)
Weight, g/mol:	237.147727
ΔH_f, kcal/mol:	-146.32
Dipole, Da:	3.07
IP(EA), eV:	-9.55(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-ethoxypyrimidin-2-yl)amino]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CCC(C)N(CC1=CC=NC=C1)C(=O)C2=CC=CC=C2OC(F)F

DOS

IR

Vibrations