Geometry & MOs

Info

ID:	137625
PubChem CID:	52236454
Reduced:	SN3O4C16H29 (1)
Stoich.:	AB3C4D16E29 (1)
Weight, g/mol:	405.172228
ΔH_f, kcal/mol:	-165.7
Dipole, Da:	2.7
IP(EA), eV:	-9.95(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(4-methylcyclohexyl)-2-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfonyl]propanamide

Drug info:

PubChemData

Smile

CCCCC[C@@H](C)NC(=O)CS(=O)(=O)CC1=NOC(=N1)CC(C)C

DOS

IR

Vibrations