Geometry & MOs

Info

ID:	289223
PubChem CID:	104341006
Reduced:	ON5C14H25 (1)
Stoich.:	AB5C14D25 (1)
Weight, g/mol:	302.141262
ΔH_f, kcal/mol:	-26.29
Dipole, Da:	3.08
IP(EA), eV:	-8.68(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-ethyl-2-(methoxymethyl)-4-N-(3-methylsulfonylpropyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)NCC2CCCCN2C)N

DOS

IR

Vibrations