Geometry & MOs

Info

ID:	310187
PubChem CID:	126576383
Reduced:	OC15H20 (1)
Stoich.:	AB15C20 (1)
Weight, g/mol:	417.175165
ΔH_f, kcal/mol:	-32.26
Dipole, Da:	1.82
IP(EA), eV:	-9.27(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[(2R,4R)-2-[(3E,5Z)-hepta-1,3,5-trien-4-yl]oxan-4-yl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](O[C@@H](C1)C2=CC=CC=C2)C3CCC3

DOS

IR

Vibrations