Geometry & MOs

Info

ID:	9899
PubChem CID:	94532
Reduced:	NOC12H19 (1)
Stoich.:	ABC12D19 (1)
Weight, g/mol:	193.146664
ΔH_f, kcal/mol:	-35.67
Dipole, Da:	0.84
IP(EA), eV:	-8.56(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-2-[ethyl(methyl)amino]-1-phenylpropan-1-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations