Geometry & MOs

Info

ID:	210683
PubChem CID:	80840189
Reduced:	BrN4C12H19 (1)
Stoich.:	AB4C12D19 (1)
Weight, g/mol:	259.154544
ΔH_f, kcal/mol:	6.13
Dipole, Da:	3.05
IP(EA), eV:	-8.6(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-imidazol-1-yl-2-N-(1-methylcyclopentyl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCNC1=NC=C(C(=N1)NC2(CCCC2)C)Br

DOS

IR

Vibrations