Geometry & MOs

Info

ID:	380606
PubChem CID:	134971096
Reduced:	NO6C18H33 (1)
Stoich.:	AB6C18D33 (1)
Weight, g/mol:	301.11365
ΔH_f, kcal/mol:	-297.74
Dipole, Da:	1.46
IP(EA), eV:	-9.71(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-3-methyl-1-(4-methylphenyl)sulfonyl-2-phenylazetidine

Drug info:

PubChemData

Smile

CC1(OC[C@@H](O1)[C@@H](CCC2C[C@H]2OCOC)NC(=O)OC(C)(C)C)C

DOS

IR

Vibrations