Geometry & MOs

Info

ID:	404277
PubChem CID:	135065646
Reduced:	O5C13H16 (1)
Stoich.:	A5B13C16 (1)
Weight, g/mol:	339.108228
ΔH_f, kcal/mol:	-204.69
Dipole, Da:	2.27
IP(EA), eV:	-8.92(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(1S)-2-hydroxy-1-[4-(trifluoromethyl)phenyl]ethyl]carbamate

Drug info:

PubChemData

Smile

CC(=O)OC[C@H](C1=CC(=CC=C1)OC)OC(=O)C

DOS

IR

Vibrations