Geometry & MOs

Info

ID:	231650
PubChem CID:	87574380
Reduced:	OSCl2N9H19C24 (1)
Stoich.:	ABC2D9E19F24 (1)
Weight, g/mol:	436.867654
ΔH_f, kcal/mol:	100.95
Dipole, Da:	7.26
IP(EA), eV:	-8.25(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=NC(=NC(=N1)N2C3=CC=CC=C3N=C2NC4=CC=C(C=C4)NC(=O)NSC5=CC(=CC(=C5)Cl)Cl)N

DOS

IR

Vibrations