Geometry & MOs

Info

ID:	289233
PubChem CID:	104341293
Reduced:	ON4C15H26 (1)
Stoich.:	AB4C15D26 (1)
Weight, g/mol:	294.241962
ΔH_f, kcal/mol:	-40.15
Dipole, Da:	5.56
IP(EA), eV:	-8.81(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxymethyl)-4-N-hexan-3-yl-6-N-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC(C)(C)C1CCN(CC1)C2=NC(=NC(=C2)N)COC

DOS

IR

Vibrations