Geometry & MOs

Info

ID:	365891
PubChem CID:	127319149
Reduced:	ON5C21H29 (1)
Stoich.:	AB5C21D29 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-0.21
Dipole, Da:	2.72
IP(EA), eV:	-8.8(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentyloxy-N-(5-phenyl-2-propan-2-ylpyrazol-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C(=CC(=N1)C2=CC=CC=C2)NC(=O)NC3CCN4C3CCCC4

DOS

IR

Vibrations