Geometry & MOs

Info

ID:	283108
PubChem CID:	103958631
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	291.231063
ΔH_f, kcal/mol:	3.18
Dipole, Da:	2.13
IP(EA), eV:	-8.2(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[2-[(1S)-1-aminopropyl]phenyl]piperazin-1-yl]-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1N(C)CC2=C(OC=C2)C)N

DOS

IR

Vibrations