Geometry & MOs

Info

ID:	360957
PubChem CID:	127301788
Reduced:	SN2O5C16H24 (1)
Stoich.:	AB2C5D16E24 (1)
Weight, g/mol:	384.036913
ΔH_f, kcal/mol:	-232.3
Dipole, Da:	8.8
IP(EA), eV:	-9.92(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]-(1,1-dioxo-1,4-thiazepan-4-yl)methanone

Drug info:

PubChemData

Smile

C1CCC2C(C1)C(=O)N(C2=O)CCC(=O)N3CCCS(=O)(=O)CC3

DOS

IR

Vibrations