Geometry & MOs

Info

ID:	255246
PubChem CID:	103130864
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	289.195426
ΔH_f, kcal/mol:	-2.76
Dipole, Da:	5.3
IP(EA), eV:	-8.95(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-2-methyl-1-(1-methylpyrazol-3-yl)-N-propylpropan-1-amine

Drug info:

PubChemData

Smile

CCNC(C1CC2CCC1O2)C3=NN(C=C3)C

DOS

IR

Vibrations