Geometry & MOs

Info

ID:	283260
PubChem CID:	103968661
Reduced:	N5C14H25 (1)
Stoich.:	A5B14C25 (1)
Weight, g/mol:	282.18559
ΔH_f, kcal/mol:	-17.09
Dipole, Da:	2.99
IP(EA), eV:	-8.71(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[[2-(ethylamino)-5-fluoropyrimidin-4-yl]amino]methyl]cyclohexyl]methanol

Drug info:

PubChemData

Smile

CC1(CC(CC(C1)(C)C)NC2=NC(=NC(=C2)N)N)C

DOS

IR

Vibrations