Geometry & MOs

Info

ID:	281231
PubChem CID:	103911551
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-13.42
Dipole, Da:	1.46
IP(EA), eV:	-9.21(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[[cyclopropyl-(2-methylphenyl)methyl]amino]propan-2-ol

Drug info:

PubChemData

Smile

C[C@H](CNC(C1CC1)C2=CC=CC=C2)O

DOS

IR

Vibrations