Geometry & MOs

Info

ID:	62108
PubChem CID:	26717595
Reduced:	SO2Cl3N3H14C18 (1)
Stoich.:	AB2C3D3E14F18 (1)
Weight, g/mol:	440.987231
ΔH_f, kcal/mol:	-13.32
Dipole, Da:	3.45
IP(EA), eV:	-9.4(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=C(C=C1)Cl)Cl)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations