Geometry & MOs

Info

ID:	362588
PubChem CID:	127308345
Reduced:	OS2N4C17H18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	366.151433
ΔH_f, kcal/mol:	23.16
Dipole, Da:	5.06
IP(EA), eV:	-8.65(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methylpyrazol-1-yl)-N-(3-thiophen-2-ylphenyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(S1)C(CCC2)N(C)C(=O)NC3=CC4=C(C=C3)SC=N4

DOS

IR

Vibrations