Geometry & MOs

Info

ID:	360812
PubChem CID:	127301457
Reduced:	S2N3O3C10H13 (1)
Stoich.:	A2B3C3D10E13 (1)
Weight, g/mol:	359.130363
ΔH_f, kcal/mol:	-40.11
Dipole, Da:	2.19
IP(EA), eV:	-9.36(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-(1H-indol-3-yl)piperidin-1-yl]sulfonylmethyl]-3-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)NCC2=NC(=CS2)C

DOS

IR

Vibrations