Geometry & MOs

Info

ID:	282557
PubChem CID:	103930880
Reduced:	SO2N3C9H17 (1)
Stoich.:	AB2C3D9E17 (1)
Weight, g/mol:	267.183444
ΔH_f, kcal/mol:	-61.33
Dipole, Da:	6.26
IP(EA), eV:	-9.35(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hexan-3-yl-3,4,5-trimethoxyaniline

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=CC=NN1C(C)C

DOS

IR

Vibrations