Geometry & MOs

Info

ID:	264894
PubChem CID:	103501435
Reduced:	ClFN3C16H17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	351.07464
ΔH_f, kcal/mol:	-7.94
Dipole, Da:	1.86
IP(EA), eV:	-8.74(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-bromo-2,5-diethylpyrazol-3-yl)methyl]-6-fluoro-2,3-dihydroindole

Drug info:

PubChemData

Smile

CC(C)C1=NC=C(C(=N1)CCl)N2CCC3=C2C=C(C=C3)F

DOS

IR

Vibrations