Geometry & MOs

Info

ID:	289086
PubChem CID:	104335273
Reduced:	ClON4C13H21 (1)
Stoich.:	ABC4D13E21 (1)
Weight, g/mol:	305.12949
ΔH_f, kcal/mol:	-18.53
Dipole, Da:	4.37
IP(EA), eV:	-8.84(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-6-chloro-2-(ethoxymethyl)-N-ethylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCN1CCN(CC1)C2=CC(=NC(=N2)COC)Cl

DOS

IR

Vibrations