Geometry & MOs

Info

ID:	289242
PubChem CID:	104341510
Reduced:	ON5C13H23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	298.104146
ΔH_f, kcal/mol:	-16.59
Dipole, Da:	3.44
IP(EA), eV:	-8.8(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-6-N-methyl-4-N-(3,4,5-trifluorophenyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CNC1=CC(=NC(=N1)COC)NCCN2CCCC2

DOS

IR

Vibrations