Geometry & MOs

Info

ID:	271629
PubChem CID:	103686184
Reduced:	BrNO2S2C14H14 (1)
Stoich.:	ABC2D2E14F14 (1)
Weight, g/mol:	313.026492
ΔH_f, kcal/mol:	-33.28
Dipole, Da:	4.73
IP(EA), eV:	-9.36(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2-thiophen-3-ylethyl)-2-(thiophen-2-ylmethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1SCC(=O)NCC(C2=CSC=C2)O)Br

DOS

IR

Vibrations