Geometry & MOs

Info

ID:	262798
PubChem CID:	103318301
Reduced:	N2C3H4 (3)
Stoich.:	A2B3C4 (3)
Weight, g/mol:	287.210996
ΔH_f, kcal/mol:	86.52
Dipole, Da:	3.96
IP(EA), eV:	-8.94(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(1-adamantyl)-N-methyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CNC1=NN2C3=C(CNCC3)C=NC2=N1

DOS

IR

Vibrations