Geometry & MOs

Info

ID:	376110
PubChem CID:	134222113
Reduced:	NSO6H25C30 (1)
Stoich.:	ABC6D25E30 (1)
Weight, g/mol:	529.155909
ΔH_f, kcal/mol:	-79.86
Dipole, Da:	5.9
IP(EA), eV:	-9.15(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 5-[[4-[2-(cyclodecapentaenyl)-2-hydroxyethoxy]phenyl]methyl]-2,4-dioxo-1,3-thiazolidine-5-carboxylate

Drug info:

PubChemData

Smile

C1=CC=CC=C(C=CC=C1)C(=O)COC2=CC=C(C=C2)CC3(C(=O)NC(=O)S3)C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations