Geometry & MOs

Info

ID:	50494
PubChem CID:	12013036
Reduced:	NOC9H11 (1)
Stoich.:	ABC9D11 (1)
Weight, g/mol:	191.1674
ΔH_f, kcal/mol:	-26.88
Dipole, Da:	2.48
IP(EA), eV:	-9.57(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[4-(2-methylpropyl)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

C1[C@H](C2=CC=CC=C2[C@H]1O)N

DOS

IR

Vibrations