Geometry & MOs

Info

ID:	275865
PubChem CID:	103818508
Reduced:	NF4H11C14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	269.12766
ΔH_f, kcal/mol:	-144.46
Dipole, Da:	1.7
IP(EA), eV:	-8.74(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylpyrazol-4-yl)methyl]-3-(1,3,4-oxadiazol-2-yl)aniline

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1F)NCC2=CC(=C(C=C2F)F)F

DOS

IR

Vibrations