Geometry & MOs

Info

ID:	402961
PubChem CID:	135058081
Reduced:	SO2N6H24C30 (1)
Stoich.:	AB2C6D24E30 (1)
Weight, g/mol:	546.183795
ΔH_f, kcal/mol:	103.38
Dipole, Da:	6.08
IP(EA), eV:	-8.68(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-acetyl-8-(4-methylphenyl)-N,4,9-triphenyl-1-thia-3,4,6,7,9-pentazaspiro[4.4]nona-2,7-diene-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1C2(N(C(=N1)C3=CC=CC=C3)C4=CC=CC=C4)N(N=C(S2)C(=O)NC5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations