Geometry & MOs

Info

ID:	388092
PubChem CID:	134988148
Reduced:	NOSCl2C10H17 (1)
Stoich.:	ABCD2E10F17 (1)
Weight, g/mol:	316.14177
ΔH_f, kcal/mol:	-77.09
Dipole, Da:	3.45
IP(EA), eV:	-8.79(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-2,2-ditert-butyl-5-(2,2-dimethylpropylidene)-1,3,4-selenadiazole

Drug info:

PubChemData

Smile

CCCSC(=C(Cl)Cl)CC(=O)NC(C)C

DOS

IR

Vibrations