Geometry & MOs

Info

ID:	425335
PubChem CID:	135125963
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	379.135448
ΔH_f, kcal/mol:	-69.4
Dipole, Da:	1.83
IP(EA), eV:	-8.76(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1,3-benzothiazol-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide

Drug info:

PubChemData

Smile

CCONC(=O)N1CCC2(CC1)OCC3=C(O2)C=CC(=C3)C4=C(N5C(=CC=N5)C=C4)C

DOS

IR

Vibrations