Geometry & MOs

Info

ID:	135558
PubChem CID:	51892318
Reduced:	NOC10H13 (1)
Stoich.:	ABC10D13 (1)
Weight, g/mol:	220.094924
ΔH_f, kcal/mol:	-30.98
Dipole, Da:	1.98
IP(EA), eV:	-9.27(0.26)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2S)-1-hydroxy-2-[3-(trifluoromethyl)phenyl]propan-2-yl]azanium

Drug info:

PubChemData

Smile

C1C[C@](C2=CC=CC=C21)(CO)N

DOS

IR

Vibrations