Geometry & MOs

Info

ID:	32145
PubChem CID:	4266378
Reduced:	ClSN2O8C43H59 (1)
Stoich.:	ABC2D8E43F59 (1)
Weight, g/mol:	520.185435
ΔH_f, kcal/mol:	-295.51
Dipole, Da:	6.27
IP(EA), eV:	-8.72(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[tert-butyl(naphthalen-2-ylsulfonyl)amino]-N-[(5-methylthiophen-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)ON=C1CC(C2(C3C1=CC(C(C3C4=C(O2)C=CC(=C4)OCCSC5=CC=CC=C5)CCCCO)CCCCO)OCC=C)N(C)C(=O)OCCCl

DOS

IR

Vibrations