Geometry & MOs

Info

ID:	157231
PubChem CID:	56422427
Reduced:	NSO5C18H23 (1)
Stoich.:	ABC5D18E23 (1)
Weight, g/mol:	357.138779
ΔH_f, kcal/mol:	-181.34
Dipole, Da:	6.6
IP(EA), eV:	-8.67(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(difluoromethoxy)-3-methoxyphenyl]-[2-(1,3-dioxolan-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2OCCO2)C(=O)CSC3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations