Geometry & MOs

Info

ID:	203138
PubChem CID:	79783756
Reduced:	FINSO3H9C14 (1)
Stoich.:	ABCDE3F9G14 (1)
Weight, g/mol:	378.0593
ΔH_f, kcal/mol:	-89.53
Dipole, Da:	3.88
IP(EA), eV:	-9.68(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bicyclo[2.2.1]heptanylmethyl)-4-(3-iodophenyl)pyrazole

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C(=O)C3=C(S2(=O)=O)C=C(C=C3)I)F

DOS

IR

Vibrations