Geometry & MOs

Info

ID:	371222
PubChem CID:	127344388
Reduced:	OSN5C14H19 (1)
Stoich.:	ABC5D14E19 (1)
Weight, g/mol:	319.146681
ΔH_f, kcal/mol:	16.26
Dipole, Da:	3.67
IP(EA), eV:	-9.37(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methylpyrazol-3-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)N2CCC(CC2)C3=CC=NN3

DOS

IR

Vibrations