Geometry & MOs

Info

ID:	371220
PubChem CID:	127344386
Reduced:	SO2N4C14H24 (1)
Stoich.:	AB2C4D14E24 (1)
Weight, g/mol:	319.146681
ΔH_f, kcal/mol:	-70.83
Dipole, Da:	5.49
IP(EA), eV:	-8.53(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)NCC(C)CN2CCOCC2

DOS

IR

Vibrations