Geometry & MOs

Info

ID:	240775
PubChem CID:	93617461
Reduced:	SN2O4C16H20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	348.114378
ΔH_f, kcal/mol:	-109.27
Dipole, Da:	6.7
IP(EA), eV:	-9.08(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)[C@H](C)S(=O)(=O)CC2=NOC(=C2)C

DOS

IR

Vibrations