Geometry & MOs

Info

ID:	405752
PubChem CID:	135075303
Reduced:	SN2O5C18H20 (1)
Stoich.:	AB2C5D18E20 (1)
Weight, g/mol:	433.301451
ΔH_f, kcal/mol:	-65.1
Dipole, Da:	4.79
IP(EA), eV:	-8.61(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-5-cyclohexylpent-4-enyl]-2,4,6-tri(propan-2-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C/CCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations