Geometry & MOs

Info

ID:	343628
PubChem CID:	127266804
Reduced:	OF2N4C17H22 (1)
Stoich.:	AB2C4D17E22 (1)
Weight, g/mol:	346.146347
ΔH_f, kcal/mol:	-106.51
Dipole, Da:	1.78
IP(EA), eV:	-9.23(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl)-1,5-dimethylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)NC(CC1=NC=CN1C(F)F)C2=CC=CC=C2

DOS

IR

Vibrations