Geometry & MOs

Info

ID:	186744
PubChem CID:	77477690
Reduced:	O2F3C19H29 (1)
Stoich.:	A2B3C19D29 (1)
Weight, g/mol:	548.205355
ΔH_f, kcal/mol:	-280.14
Dipole, Da:	5.15
IP(EA), eV:	-9.39(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-chloro-1-(2-morpholin-4-ylethoxy)spiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one

Drug info:

PubChemData

Smile

CCC1=C(OC2C3(C1CCC(C3CCC(O2)(C)C)C)C)C(F)(F)F

DOS

IR

Vibrations