Geometry & MOs

Info

ID:	44219
PubChem CID:	10502046
Reduced:	N2S2O5C18H28 (1)
Stoich.:	A2B2C5D18E28 (1)
Weight, g/mol:	416.213364
ΔH_f, kcal/mol:	-174.87
Dipole, Da:	7.64
IP(EA), eV:	-8.72(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-(3-methoxyphenyl)methylideneamino]-2,4,6-tri(propan-2-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCCSC([C@@H]2C(=O)NO)(C)C

DOS

IR

Vibrations