Geometry & MOs

Info

ID:	345636
PubChem CID:	127269936
Reduced:	O2N6C19H30 (1)
Stoich.:	A2B6C19D30 (1)
Weight, g/mol:	337.18017
ΔH_f, kcal/mol:	-89.36
Dipole, Da:	4.79
IP(EA), eV:	-9.56(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxan-2-ylmethyl)-4-(4-fluoroanilino)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)CNC(=O)N2CCC(CC2)NC(=O)NC3CCCCC3

DOS

IR

Vibrations