Geometry & MOs

Info

ID:	404085
PubChem CID:	135064944
Reduced:	NF2O3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	287.152144
ΔH_f, kcal/mol:	-205.13
Dipole, Da:	5.07
IP(EA), eV:	-9.46(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(S)-cyclohexyl-(2-hydroxyanilino)methyl]-2H-furan-5-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)[C@@H](C(C(=O)C2=CC=CC=C2)(F)F)NC(=O)OC(C)(C)C

DOS

IR

Vibrations