Geometry & MOs

Info

ID:	285189
PubChem CID:	104098529
Reduced:	ON7C9H11 (1)
Stoich.:	AB7C9D11 (1)
Weight, g/mol:	204.112344
ΔH_f, kcal/mol:	69.95
Dipole, Da:	0.56
IP(EA), eV:	-9.61(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[2-(triazol-1-yl)ethyl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

C1=CC(=NN=C1C(=O)N)NCCN2C=CN=N2

DOS

IR

Vibrations