Geometry & MOs

Info

ID:	7286
PubChem CID:	71934
Reduced:	NO2C20H27 (1)
Stoich.:	AB2C20D27 (1)
Weight, g/mol:	313.204179
ΔH_f, kcal/mol:	-63.13
Dipole, Da:	3.24
IP(EA), eV:	-8.88(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[2-(1-phenylpropan-2-ylamino)ethoxy]phenyl]propan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=CC=C(C=C1)OCCNC(C)CC2=CC=CC=C2)O

DOS

IR

Vibrations