Geometry & MOs

Info

ID:	171480
PubChem CID:	75383207
Reduced:	SO2N3C17H33 (1)
Stoich.:	AB2C3D17E33 (1)
Weight, g/mol:	325.196569
ΔH_f, kcal/mol:	-118.21
Dipole, Da:	5.34
IP(EA), eV:	-8.58(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[1-(3,5-difluorophenyl)ethylamino]piperidin-1-yl]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCC(CC1)NC2CCCN(C2)C3CCCCC3

DOS

IR

Vibrations