Geometry & MOs

Info

ID:	260537
PubChem CID:	103194680
Reduced:	FON3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	265.19026
ΔH_f, kcal/mol:	-82.79
Dipole, Da:	2.28
IP(EA), eV:	-8.73(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3-aminopyrazol-1-yl)propyl]-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CCCN(C1)CC2=C(C=C(C=C2)F)N

DOS

IR

Vibrations