Geometry & MOs

Info

ID:	199909
PubChem CID:	79316711
Reduced:	ON5C12H19 (1)
Stoich.:	AB5C12D19 (1)
Weight, g/mol:	263.17461
ΔH_f, kcal/mol:	36.15
Dipole, Da:	0.73
IP(EA), eV:	-9.8(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(azetidin-3-yl)-N-(1-cyclopentylethyl)triazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(CC1CC1)NC(=O)C2=CN(N=N2)C3CNC3

DOS

IR

Vibrations