Geometry & MOs

Info

ID:	404905
PubChem CID:	135071696
Reduced:	NSO3C30H31 (1)
Stoich.:	ABC3D30E31 (1)
Weight, g/mol:	467.195042
ΔH_f, kcal/mol:	27.88
Dipole, Da:	5.0
IP(EA), eV:	-9.15(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[tert-butyl(dimethyl)silyl]oxybut-2-ynyl]-4-methyl-N-(3-phenylprop-2-ynyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C(CC2=CC=CC=C2)C(C#CC3CC3)(C4=CC=CC=C4)O

DOS

IR

Vibrations