Geometry & MOs

Info

ID:	289191
PubChem CID:	104339393
Reduced:	ON4C14H26 (1)
Stoich.:	AB4C14D26 (1)
Weight, g/mol:	280.226312
ΔH_f, kcal/mol:	-40.27
Dipole, Da:	5.09
IP(EA), eV:	-8.67(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-butan-2-yl-4-N-ethyl-2-(methoxymethyl)-6-N-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC(C)N(CC)C1=NC(=NC(=C1)NC)COCC

DOS

IR

Vibrations