Geometry & MOs

Info

ID:	277015
PubChem CID:	103826252
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	-18.93
Dipole, Da:	9.93
IP(EA), eV:	-9.26(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzofuran-3-ylmethyl)-2-(3-methoxyphenyl)ethanamine

Drug info:

PubChemData

Smile

COC1CCCC(C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

DOS

IR

Vibrations