Geometry & MOs

Info

ID:	251864
PubChem CID:	103107456
Reduced:	ON2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	238.142976
ΔH_f, kcal/mol:	-22.87
Dipole, Da:	5.05
IP(EA), eV:	-9.41(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(2-piperidin-1-ylethyl)triazole-4-carboxylate

Drug info:

PubChemData

Smile

CN(C)CCN1C=C(N=N1)C(=O)OC

DOS

IR

Vibrations