Geometry & MOs

Info

ID:	362787
PubChem CID:	127309335
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	395.232125
ΔH_f, kcal/mol:	51.4
Dipole, Da:	3.03
IP(EA), eV:	-8.86(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1-phenylpyrazol-3-yl)ethyl]-3-(pyrrolidine-1-carbonyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)NCCC3=NN(C=C3)C4=CC=CC=C4)O

DOS

IR

Vibrations