Geometry & MOs

Info

ID:	249372
PubChem CID:	103089007
Reduced:	OSN2C11H26 (1)
Stoich.:	ABC2D11E26 (1)
Weight, g/mol:	342.037182
ΔH_f, kcal/mol:	-77.93
Dipole, Da:	1.18
IP(EA), eV:	-8.56(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(aminomethyl)pentan-3-yl]-2,4-dichloro-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC(CCCO)NC(CCCSC)CN

DOS

IR

Vibrations