Geometry & MOs

Info

ID:	210512
PubChem CID:	80817386
Reduced:	FSN4C10H11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	256.168797
ΔH_f, kcal/mol:	13.5
Dipole, Da:	3.91
IP(EA), eV:	-8.81(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(3,5-dimethylphenyl)-2-N,4-N,5-trimethylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(S1)CNC2=NC(=NC=C2F)N

DOS

IR

Vibrations