Geometry & MOs

Info

ID:	202774
PubChem CID:	79723745
Reduced:	FN4C10H11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	287.138225
ΔH_f, kcal/mol:	29.95
Dipole, Da:	2.85
IP(EA), eV:	-9.35(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-6-[(5-ethylpyridin-2-yl)methyl]-5-nitropyrimidin-4-amine

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C(C2=NC=C(C=C2)F)N

DOS

IR

Vibrations