Geometry & MOs

Info

ID:	237291
PubChem CID:	92718097
Reduced:	ClSO3N4C22H25 (1)
Stoich.:	ABC3D4E22F25 (1)
Weight, g/mol:	469.041853
ΔH_f, kcal/mol:	-96.14
Dipole, Da:	3.47
IP(EA), eV:	-9.42(-1.42)
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-[(R)-(4-chlorophenyl)-phenylmethyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NN=C(O4)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations