Geometry & MOs

Info

ID:	197082
PubChem CID:	78919889
Reduced:	ON3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	43.34
Dipole, Da:	5.05
IP(EA), eV:	-8.21(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-methoxy-1-benzofuran-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CN1C=CC(=N1)CNCC2=C(C=CC3=CC=CC=C32)OC

DOS

IR

Vibrations