Geometry & MOs

Info

ID:	249249
PubChem CID:	103088058
Reduced:	NSC14H29 (1)
Stoich.:	ABC14D29 (1)
Weight, g/mol:	323.990232
ΔH_f, kcal/mol:	-46.93
Dipole, Da:	1.62
IP(EA), eV:	-8.51(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCC(CC1)CCNCCCCSC

DOS

IR

Vibrations