Geometry & MOs

Info

ID:	280814
PubChem CID:	103851399
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	259.148476
ΔH_f, kcal/mol:	49.15
Dipole, Da:	3.16
IP(EA), eV:	-8.85(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-fluoro-2,3-dihydro-1H-inden-1-amine

Drug info:

PubChemData

Smile

CN1CCCC1CNCC2=CC=CC=C2C#N

DOS

IR

Vibrations