Geometry & MOs

Info

ID:	257911
PubChem CID:	103149162
Reduced:	BrClNOF2C13H17 (1)
Stoich.:	ABCDE2F13G17 (1)
Weight, g/mol:	233.133969
ΔH_f, kcal/mol:	-142.61
Dipole, Da:	2.67
IP(EA), eV:	-9.0(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC(CCOCC(F)F)CC1=C(C=C(C=C1)Br)Cl

DOS

IR

Vibrations