Geometry & MOs

Info

ID:	210079
PubChem CID:	80759293
Reduced:	BrF2N4H7C10 (1)
Stoich.:	AB2C4D7E10 (1)
Weight, g/mol:	298.05005
ΔH_f, kcal/mol:	-17.77
Dipole, Da:	1.53
IP(EA), eV:	-9.02(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)F)NC2=NC(=NC=C2F)N

DOS

IR

Vibrations