Geometry & MOs

Info

ID:	56537
PubChem CID:	17436170
Reduced:	SO3N4C24H28 (1)
Stoich.:	AB3C4D24E28 (1)
Weight, g/mol:	387.080826
ΔH_f, kcal/mol:	-105.93
Dipole, Da:	6.03
IP(EA), eV:	-8.82(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)CC(=O)NCC(=O)NC4=C(C=C(C=C4C)C)C

DOS

IR

Vibrations