Geometry & MOs

Info

ID:	196210
PubChem CID:	78797927
Reduced:	S2N3O3C16H25 (1)
Stoich.:	A2B3C3D16E25 (1)
Weight, g/mol:	345.118084
ΔH_f, kcal/mol:	-118.93
Dipole, Da:	1.55
IP(EA), eV:	-8.78(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2,5-dimethylthiophen-3-yl)sulfonylpiperazin-1-yl]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)S(=O)(=O)N2CCN(CC2)CC(=O)N3CCCC3

DOS

IR

Vibrations