Geometry & MOs

Info

ID:	293685
PubChem CID:	117396703
Reduced:	NO2C16H19 (1)
Stoich.:	AB2C16D19 (1)
Weight, g/mol:	257.141579
ΔH_f, kcal/mol:	-40.79
Dipole, Da:	3.54
IP(EA), eV:	-8.48(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-aminopropan-2-yl)-2-phenylmethoxyphenol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=CC(=C2O)CCCN

DOS

IR

Vibrations