Geometry & MOs

Info

ID:	280782
PubChem CID:	103851243
Reduced:	F2N2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	255.137162
ΔH_f, kcal/mol:	-92.88
Dipole, Da:	4.96
IP(EA), eV:	-8.83(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzofuran-2-yl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]methanamine

Drug info:

PubChemData

Smile

CC1CCN(CC1)CCNCC2=CC(=CC(=C2)F)F

DOS

IR

Vibrations