Geometry & MOs

Info

ID:	404552
PubChem CID:	135066714
Reduced:	NO2H17C19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	370.098728
ΔH_f, kcal/mol:	-6.88
Dipole, Da:	3.76
IP(EA), eV:	-8.37(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-3-[(4R,5S)-5-naphthalen-2-yl-2-sulfanylidene-1,3-oxazolidine-4-carbonyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

COC(=O)C1=CN(C(C=C1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations