Geometry & MOs

Info

ID:	404951
PubChem CID:	135071851
Reduced:	NSO3C33H35 (1)
Stoich.:	ABC3D33E35 (1)
Weight, g/mol:	507.186815
ΔH_f, kcal/mol:	-3.35
Dipole, Da:	5.3
IP(EA), eV:	-8.89(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-1,2,4-triphenylbut-3-ynyl)-4-methyl-N-prop-2-enylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C)C(CC2=CC=CC=C2)C(C#CC3=CCCCC3)(C4=CC=CC=C4)O

DOS

IR

Vibrations