Geometry & MOs

Info

ID:	283591
PubChem CID:	103991022
Reduced:	ClNC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	213.092042
ΔH_f, kcal/mol:	16.97
Dipole, Da:	2.1
IP(EA), eV:	-9.16(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[(4-chloro-3-methylphenyl)methylamino]propan-2-ol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CNCC2CC2)Cl

DOS

IR

Vibrations