Geometry & MOs

Info

ID:	323142
PubChem CID:	126672883
Reduced:	ON4H12C17 (1)
Stoich.:	AB4C12D17 (1)
Weight, g/mol:	320.147096
ΔH_f, kcal/mol:	94.72
Dipole, Da:	1.99
IP(EA), eV:	-9.01(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclohexyl-5-(3-fluorophenyl)-7,7a-dihydro-6H-imidazo[2,1-b][1,3,4]thiadiazol-2-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)O)C2=CN=C3N2N=C(C=C3)C4=CC=NC=C4

DOS

IR

Vibrations