Geometry & MOs

Info

ID:	426360
PubChem CID:	135143586
Reduced:	BrO2N3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	324.148535
ΔH_f, kcal/mol:	-45.99
Dipole, Da:	6.6
IP(EA), eV:	-9.06(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-4-(3-fluorophenyl)-3-(methylcarbamoyl)-1,3-oxazolidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1N(C(=O)C(N1C(=O)NC)(CC2=CC=CC=C2)C3=CC(=CC=C3)Br)C

DOS

IR

Vibrations