Geometry & MOs

Info

ID:	237200
PubChem CID:	92717874
Reduced:	ClN2O5H21C26 (1)
Stoich.:	AB2C5D21E26 (1)
Weight, g/mol:	479.070655
ΔH_f, kcal/mol:	-135.6
Dipole, Da:	6.01
IP(EA), eV:	-9.51(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[(R)-(4-chlorophenyl)-phenylmethyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)OCC(=O)N[C@H](C1=CC=CC=C1)C2=CC=C(C=C2)Cl)N3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations