Geometry & MOs

Info

ID:	249246
PubChem CID:	103088036
Reduced:	NSC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	309.974582
ΔH_f, kcal/mol:	-36.92
Dipole, Da:	1.59
IP(EA), eV:	-8.5(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dichloro-N-(1-cyanopropan-2-yl)-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1(CCCC1)CNCCCCSC

DOS

IR

Vibrations