Geometry & MOs

Info

ID:	394886
PubChem CID:	135024028
Reduced:	OSN2H26C28 (1)
Stoich.:	ABC2D26E28 (1)
Weight, g/mol:	487.86436
ΔH_f, kcal/mol:	46.81
Dipole, Da:	3.19
IP(EA), eV:	-8.57(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2C3CCC(C3)(C2C(=O)NC4=CC=CC5=C4N=CC=C5)C6=CC=CS6

DOS

IR

Vibrations