Geometry & MOs

Info

ID:	406227
PubChem CID:	135076976
Reduced:	BrNSi2C24H46 (1)
Stoich.:	ABC2D24E46 (1)
Weight, g/mol:	403.1606
ΔH_f, kcal/mol:	-139.65
Dipole, Da:	2.44
IP(EA), eV:	-8.37(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethynyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC(=C1N([Si](C)(C)C)[Si](C)(C)C)C(C)C)CCCCCCBr

DOS

IR

Vibrations