Geometry & MOs

Info

ID:	265610
PubChem CID:	103533182
Reduced:	N2F3O3C12H19 (1)
Stoich.:	A2B3C3D12E19 (1)
Weight, g/mol:	286.189257
ΔH_f, kcal/mol:	-284.02
Dipole, Da:	4.25
IP(EA), eV:	-9.62(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethoxypyrrolidin-1-yl)-3-piperidin-4-yloxypropan-1-one

Drug info:

PubChemData

Smile

COC1CN(CC1OC)C(=O)C2(CCNC2)C(F)(F)F

DOS

IR

Vibrations