Geometry & MOs

Info

ID:	131254
PubChem CID:	51182141
Reduced:	NO4C19H23 (1)
Stoich.:	AB4C19D23 (1)
Weight, g/mol:	391.07574
ΔH_f, kcal/mol:	-115.95
Dipole, Da:	6.22
IP(EA), eV:	-8.79(-0.43)
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-[4-(furan-2-yl)butan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(CCC1=CC=CO1)NC(=O)/C=C/C2=C(C=C(C=C2)OC)OC

DOS

IR

Vibrations