Geometry & MOs

Info

ID:	289160
PubChem CID:	104337920
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	-15.0
Dipole, Da:	3.67
IP(EA), eV:	-8.86(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-N-propyl-6-(pyridin-4-ylmethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)NC)C2=C(C=C(C(=C2)C)C)C

DOS

IR

Vibrations