Geometry & MOs

Info

ID:	199905
PubChem CID:	79316541
Reduced:	O2N5C13H21 (1)
Stoich.:	A2B5C13D21 (1)
Weight, g/mol:	278.185509
ΔH_f, kcal/mol:	-15.29
Dipole, Da:	4.87
IP(EA), eV:	-9.28(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(azetidin-3-yl)-N-[(1-methylpiperidin-3-yl)methyl]triazole-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1CCCN(C1)C(=O)C2=CN(N=N2)C3CNC3

DOS

IR

Vibrations