Geometry & MOs

Info

ID:	289134
PubChem CID:	104337313
Reduced:	ClON4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	263.08254
ΔH_f, kcal/mol:	21.55
Dipole, Da:	1.19
IP(EA), eV:	-9.78(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(ethoxymethyl)-6-(pyridin-2-ylmethyl)pyrimidine

Drug info:

PubChemData

Smile

CCN1C(=CC=N1)C2=CC(=NC(=N2)COCC)Cl

DOS

IR

Vibrations