Geometry & MOs

Info

ID:	171550
PubChem CID:	75393207
Reduced:	FO2N4C16H23 (1)
Stoich.:	AB2C4D16E23 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-117.26
Dipole, Da:	1.55
IP(EA), eV:	-8.81(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzyl-2-oxopiperidin-3-yl)-1-ethylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)NCC(=O)N1CCN(CC1)C2=C(C=CC=N2)F

DOS

IR

Vibrations