Geometry & MOs

Info

ID:	158996
PubChem CID:	57244446
Reduced:	OSN3F6C30H33 (1)
Stoich.:	ABC3D6E30F33 (1)
Weight, g/mol:	319.153206
ΔH_f, kcal/mol:	-275.61
Dipole, Da:	3.07
IP(EA), eV:	-8.66(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(5S)-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C[C@@H]2CN(CCN2C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CC#CCN4CCSCC4)C

DOS

IR

Vibrations