Geometry & MOs

Info

ID:	210496
PubChem CID:	80814995
Reduced:	F3N4C10H15 (1)
Stoich.:	A3B4C10D15 (1)
Weight, g/mol:	326.03539
ΔH_f, kcal/mol:	-141.21
Dipole, Da:	2.04
IP(EA), eV:	-8.81(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-N-methyl-4-N-propan-2-yl-4-N-(2,2,2-trifluoroethyl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCN(CC(F)(F)F)C1=NC(=NC(=C1)C)NC

DOS

IR

Vibrations