Geometry & MOs

Info

ID:	347419
PubChem CID:	127272268
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	345.162332
ΔH_f, kcal/mol:	-60.31
Dipole, Da:	3.8
IP(EA), eV:	-8.55(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-4-(1,3-thiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)N[C@@H]1[C@@H](CC2=CC=CC=C12)O)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations