Geometry & MOs

Info

ID:	250938
PubChem CID:	103100224
Reduced:	ClNS2O3C14H22 (1)
Stoich.:	ABC2D3E14F22 (1)
Weight, g/mol:	309.026013
ΔH_f, kcal/mol:	-134.01
Dipole, Da:	6.8
IP(EA), eV:	-9.62(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-4-methylthiophen-2-yl)sulfonyl-3-propylazetidin-3-ol

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCC2(CCC(CC2)(C)C)O)Cl

DOS

IR

Vibrations