Geometry & MOs

Info

ID:	78811
PubChem CID:	49733781
Reduced:	SF2O2N3C19H23 (1)
Stoich.:	AB2C2D3E19F23 (1)
Weight, g/mol:	423.061982
ΔH_f, kcal/mol:	-156.46
Dipole, Da:	4.96
IP(EA), eV:	-9.35(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-4-[(4,6-difluoro-1,3-benzothiazol-2-yl)oxy]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)N2CCC(CC2)OC3=NC4=C(C=C(C=C4S3)F)F

DOS

IR

Vibrations