Geometry & MOs

Info

ID:	202085
PubChem CID:	79626602
Reduced:	NO2C17H29 (1)
Stoich.:	AB2C17D29 (1)
Weight, g/mol:	235.193614
ΔH_f, kcal/mol:	-90.38
Dipole, Da:	0.88
IP(EA), eV:	-8.68(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-3-(4-methylphenoxy)-N-propan-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C)CNCC(C)(C)COC1=CC=CC(=C1)COC

DOS

IR

Vibrations