Geometry & MOs

Info

ID:	210203
PubChem CID:	80774237
Reduced:	SO2N8C10H14 (1)
Stoich.:	AB2C8D10E14 (1)
Weight, g/mol:	286.07931
ΔH_f, kcal/mol:	31.11
Dipole, Da:	6.8
IP(EA), eV:	-10.09(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-N,4-N-diethyl-4-N-propan-2-ylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)N2CCS(=O)(=O)CC2)N3C=NC=N3

DOS

IR

Vibrations