Geometry & MOs

Info

ID:	371169
PubChem CID:	127343833
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	366.241962
ΔH_f, kcal/mol:	-0.24
Dipole, Da:	2.04
IP(EA), eV:	-9.15(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-ethylpyrazol-4-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)CNC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations