Geometry & MOs

Info

ID:	236823
PubChem CID:	92714820
Reduced:	SN2O3H18C19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	368.119464
ΔH_f, kcal/mol:	-47.77
Dipole, Da:	6.13
IP(EA), eV:	-8.39(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[4-[(3R)-3-phenylpyrrolidin-1-yl]sulfonylphenyl]-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)C4=COC(=N4)C

DOS

IR

Vibrations