Geometry & MOs

Info

ID:	155520
PubChem CID:	56365856
Reduced:	FN2O2C25H31 (1)
Stoich.:	AB2C2D25E31 (1)
Weight, g/mol:	416.267508
ΔH_f, kcal/mol:	-114.0
Dipole, Da:	7.88
IP(EA), eV:	-9.3(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzoylpiperidin-4-yl)-2-(oxan-2-ylmethoxy)-N-propylpropanamide

Drug info:

PubChemData

Smile

CCCN(C1CCN(CC1)C(=O)C2=CC=CC=C2)C(=O)C(C)CC3=CC(=CC=C3)F

DOS

IR

Vibrations