Geometry & MOs

Info

ID:	19387
PubChem CID:	562871
Reduced:	SN2O3C13H20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	284.119464
ΔH_f, kcal/mol:	-105.53
Dipole, Da:	5.67
IP(EA), eV:	-9.55(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N'-butyl-N-(4-methylphenyl)sulfonylcarbamimidate

Drug info:

PubChemData

Smile

CCCCN=C(NS(=O)(=O)C1=CC=C(C=C1)C)OC

DOS

IR

Vibrations