Geometry & MOs

Info

ID:	413929
PubChem CID:	135086880
Reduced:	NSO2H19C24 (1)
Stoich.:	ABC2D19E24 (1)
Weight, g/mol:	372.093249
ΔH_f, kcal/mol:	96.27
Dipole, Da:	6.84
IP(EA), eV:	-8.19(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethynylphenyl)-4-methyl-N-(2-pyridin-3-ylethynyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C#CN(C2=CC=CC=C2C#C)S(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations