Geometry & MOs

Info

ID:	234
PubChem CID:	2377
Reduced:	NOC18H23 (1)
Stoich.:	ABC18D23 (1)
Weight, g/mol:	269.177964
ΔH_f, kcal/mol:	-6.67
Dipole, Da:	1.59
IP(EA), eV:	-8.72(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-benzylphenoxy)-N-methylbutan-1-amine

Drug info:

PubChemData

Smile

CNCCCCOC1=CC=CC=C1CC2=CC=CC=C2

DOS

IR

Vibrations