Geometry & MOs

Info

ID:	406907
PubChem CID:	135078891
Reduced:	SN2O3H16C22 (1)
Stoich.:	AB2C3D16E22 (1)
Weight, g/mol:	491.285801
ΔH_f, kcal/mol:	29.4
Dipole, Da:	5.1
IP(EA), eV:	-9.19(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(1Z)-cyclopentadecen-1-yl]methyl]-N-(2-ethynylphenyl)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C(=N\S(=O)(=O)C2=CC=CC3=C2N=CC=C3)/C=C/C4=CC=CO4

DOS

IR

Vibrations