Geometry & MOs

Info

ID:	275795
PubChem CID:	103817830
Reduced:	FNO2C7H9 (2)
Stoich.:	ABC2D7E9 (2)
Weight, g/mol:	295.113233
ΔH_f, kcal/mol:	-272.29
Dipole, Da:	4.72
IP(EA), eV:	-8.71(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-difluoro-N-[(1-propan-2-ylpyrazol-4-yl)methyl]-1,3-benzodioxol-5-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCNC1=CC2=C(C=C1)OC(O2)(F)F

DOS

IR

Vibrations