Geometry & MOs

Info

ID:	423085
PubChem CID:	135118914
Reduced:	FON6C12H17 (1)
Stoich.:	ABC6D12E17 (1)
Weight, g/mol:	355.225977
ΔH_f, kcal/mol:	-6.84
Dipole, Da:	3.39
IP(EA), eV:	-9.05(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-3-(1-propan-2-ylimidazol-2-yl)piperidine

Drug info:

PubChemData

Smile

CC(C)N1C=NN=C1CN(C)C2=NC=C(C(=N2)OC)F

DOS

IR

Vibrations