Geometry & MOs

Info

ID:	195828
PubChem CID:	78736788
Reduced:	OSN4H14C16 (1)
Stoich.:	ABC4D14E16 (1)
Weight, g/mol:	289.112307
ΔH_f, kcal/mol:	92.73
Dipole, Da:	5.12
IP(EA), eV:	-9.17(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(C2(C1(C3(N=C2N)OCCS3)C#N)C#N)C4=CC=CC=C4

DOS

IR

Vibrations