Geometry & MOs

Info

ID:	236822
PubChem CID:	92714815
Reduced:	Cl2O2S2N3C17H23 (1)
Stoich.:	A2B2C2D3E17F23 (1)
Weight, g/mol:	354.103814
ΔH_f, kcal/mol:	-46.99
Dipole, Da:	8.67
IP(EA), eV:	-8.94(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[4-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]phenyl]-1,3-oxazole

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SC[C@@H]3CC3(Cl)Cl

DOS

IR

Vibrations