Geometry & MOs

Info

ID:	353355
PubChem CID:	127284684
Reduced:	SN2O2C23H28 (1)
Stoich.:	AB2C2D23E28 (1)
Weight, g/mol:	292.124549
ΔH_f, kcal/mol:	-61.32
Dipole, Da:	2.45
IP(EA), eV:	-8.63(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyl-1,3-thiazol-5-yl)methyl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)OC

DOS

IR

Vibrations