Geometry & MOs

Info

ID:	210120
PubChem CID:	80766263
Reduced:	ON5C9H17 (1)
Stoich.:	AB5C9D17 (1)
Weight, g/mol:	214.122989
ΔH_f, kcal/mol:	-18.4
Dipole, Da:	1.86
IP(EA), eV:	-9.24(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-ethyl-5-fluoro-4-N-(2-methoxyethyl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCOC1=NC(=NC(=N1)NC(C)C)NC

DOS

IR

Vibrations