Geometry & MOs

Info

ID:	367791
PubChem CID:	127325827
Reduced:	N2S2O3C14H20 (1)
Stoich.:	A2B2C3D14E20 (1)
Weight, g/mol:	350.049191
ΔH_f, kcal/mol:	-111.53
Dipole, Da:	8.02
IP(EA), eV:	-9.52(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCC2)NC(=O)CC3CCS(=O)(=O)C3

DOS

IR

Vibrations