Geometry & MOs

Info

ID:	248371
PubChem CID:	103081100
Reduced:	NF2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	281.133969
ΔH_f, kcal/mol:	-209.41
Dipole, Da:	6.35
IP(EA), eV:	-8.2(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-difluoroethoxy)-N-[(4-pyrazol-1-ylphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC1CC2=CC(=C(C=C2O1)CNCCOCC(F)F)OC

DOS

IR

Vibrations