Geometry & MOs

Info

ID:	255212
PubChem CID:	103130690
Reduced:	ON4C12H22 (1)
Stoich.:	AB4C12D22 (1)
Weight, g/mol:	221.09644
ΔH_f, kcal/mol:	-2.45
Dipole, Da:	4.4
IP(EA), eV:	-8.23(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-5-fluorophenyl)-(1-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CN1CCCN(C(C1)C(C2=NN(C=C2)C)O)C

DOS

IR

Vibrations