Geometry & MOs

Info

ID:	289202
PubChem CID:	104339930
Reduced:	ON2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	278.210661
ΔH_f, kcal/mol:	-70.69
Dipole, Da:	3.51
IP(EA), eV:	-8.91(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxymethyl)-N-ethyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCN(CCO)C1=NC(=NC(=C1)NC)COCC

DOS

IR

Vibrations