Geometry & MOs

Info

ID:	379614
PubChem CID:	134450799
Reduced:	SN2O5C22H22 (1)
Stoich.:	AB2C5D22E22 (1)
Weight, g/mol:	443.115107
ΔH_f, kcal/mol:	-113.22
Dipole, Da:	5.76
IP(EA), eV:	-8.63(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl [(2R,3R)-2-methyl-3-[(5-oxo-2H-1,2,4-oxadiazol-3-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-yl]sulfonylformate

Drug info:

PubChemData

Smile

CN1C=CN=C1O[C@H]2CC(C3=CC=CC=C3C2)S(=O)(=O)C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations