Geometry & MOs

Info

ID:	50549
PubChem CID:	12013096
Reduced:	ClSN3C19H26 (1)
Stoich.:	ABC3D19E26 (1)
Weight, g/mol:	343.208219
ΔH_f, kcal/mol:	41.72
Dipole, Da:	4.39
IP(EA), eV:	-9.2(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-1-thia-3,4-diazaspiro[4.11]hexadec-3-en-2-imine

Drug info:

PubChemData

Smile

C1CCCCCC2(CCCCC1)N=NC(=NC3=CC=CC=C3Cl)S2

DOS

IR

Vibrations