Geometry & MOs

Info

ID:	287248
PubChem CID:	104234161
Reduced:	FNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	263.14339
ΔH_f, kcal/mol:	-124.32
Dipole, Da:	5.19
IP(EA), eV:	-8.9(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(2,5-dimethylpyrazol-3-yl)methoxy]-3-fluorophenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCCC2CCCO2)F)N

DOS

IR

Vibrations