Geometry & MOs

Info

ID:	270628
PubChem CID:	103637380
Reduced:	NO2C18H23 (1)
Stoich.:	AB2C18D23 (1)
Weight, g/mol:	257.157978
ΔH_f, kcal/mol:	-55.54
Dipole, Da:	3.77
IP(EA), eV:	-8.21(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-N-[(4-fluoro-2-methylphenyl)methyl]methanamine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNCC2=C(C(=CC=C2)OCC)O

DOS

IR

Vibrations