Geometry & MOs

Info

ID:	347479
PubChem CID:	127272334
Reduced:	OSN6C19H24 (1)
Stoich.:	ABC6D19E24 (1)
Weight, g/mol:	306.12628
ΔH_f, kcal/mol:	44.05
Dipole, Da:	2.84
IP(EA), eV:	-9.16(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-thiazol-2-yl)-N-[2-(1,2,4-triazol-1-yl)ethyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NN=C2N1C=CC=C2)NC(=O)N3CCC(CC3)C4=NC=CS4

DOS

IR

Vibrations