Geometry & MOs

Info

ID:	414039
PubChem CID:	135086992
Reduced:	PN2O2C17H21 (1)
Stoich.:	AB2C2D17E21 (1)
Weight, g/mol:	371.119129
ΔH_f, kcal/mol:	-78.46
Dipole, Da:	4.89
IP(EA), eV:	-9.26(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(2-oxoethyl)-N-(4-phenylmethoxybut-2-ynyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)NP(=NC(=O)OC)(C1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations