Geometry & MOs

Info

ID:	255302
PubChem CID:	103131244
Reduced:	FON3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	287.10456
ΔH_f, kcal/mol:	-26.96
Dipole, Da:	2.52
IP(EA), eV:	-8.72(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-fluoro-2-(trifluoromethyl)phenyl]-N-methyl-1-(1-methylpyrazol-3-yl)methanamine

Drug info:

PubChemData

Smile

CCNC(C1=C(C=C(C=C1)OC)F)C2=NN(C=C2)C

DOS

IR

Vibrations