Geometry & MOs

Info

ID:	260712
PubChem CID:	103201090
Reduced:	O2N5C8H9 (1)
Stoich.:	A2B5C8D9 (1)
Weight, g/mol:	276.133474
ΔH_f, kcal/mol:	0.15
Dipole, Da:	8.07
IP(EA), eV:	-10.35(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[7-(aminomethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(N2C(=NC(=N2)CC(=O)O)N=C1)CN

DOS

IR

Vibrations