Geometry & MOs

Info

ID:	265535
PubChem CID:	103529323
Reduced:	BrNF5H9C10 (1)
Stoich.:	ABC5D9E10 (1)
Weight, g/mol:	281.15151
ΔH_f, kcal/mol:	-226.78
Dipole, Da:	4.15
IP(EA), eV:	-9.93(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-tert-butyl-1-methylpyrazol-4-yl)methyl]-2,2,3,3-tetrafluoropropan-1-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CNCC(C(F)F)(F)F)Br)F

DOS

IR

Vibrations