Geometry & MOs

Info

ID:	197405
PubChem CID:	78962996
Reduced:	SO2N4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	271.133907
ΔH_f, kcal/mol:	37.12
Dipole, Da:	7.2
IP(EA), eV:	-9.09(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chloro-2-methoxyphenyl)methyl-ethylamino]-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

CC1=NN(C(=C1[N+](=O)[O-])NCC(C)(C)C2=CC=CS2)C

DOS

IR

Vibrations