Geometry & MOs

Info

ID:	73489
PubChem CID:	48417886
Reduced:	FOSN3C21H22 (1)
Stoich.:	ABCD3E21F22 (1)
Weight, g/mol:	377.156184
ΔH_f, kcal/mol:	-35.62
Dipole, Da:	3.24
IP(EA), eV:	-8.55(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)CCC2=CC=CC=C2F)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations