Geometry & MOs

Info

ID:	28488
PubChem CID:	827947
Reduced:	NO2C19H27 (1)
Stoich.:	AB2C19D27 (1)
Weight, g/mol:	294.048129
ΔH_f, kcal/mol:	-104.6
Dipole, Da:	4.99
IP(EA), eV:	-9.08(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)sulfonyl-1,3,5-trimethylbenzene

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)NC(=O)C2CCC(CC2)C(C)(C)C

DOS

IR

Vibrations