Geometry & MOs

Info

ID:	280792
PubChem CID:	103851293
Reduced:	N3C17H25 (1)
Stoich.:	A3B17C25 (1)
Weight, g/mol:	297.145282
ΔH_f, kcal/mol:	33.07
Dipole, Da:	3.5
IP(EA), eV:	-8.43(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-3,3,3-trifluoro-1-phenylpropan-1-amine

Drug info:

PubChemData

Smile

CC(CNCC1=CC=CC=C1C#N)CN2CCCCC2

DOS

IR

Vibrations