Geometry & MOs

Info

ID:	257970
PubChem CID:	103149377
Reduced:	OF2N2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	275.180919
ΔH_f, kcal/mol:	-129.31
Dipole, Da:	5.22
IP(EA), eV:	-9.38(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-difluoroethoxy)-N-methyl-1-(1-propan-2-ylpyrazol-3-yl)butan-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=NC=C1)C(CCOCC(F)F)NC

DOS

IR

Vibrations