Geometry & MOs

Info

ID:	235565
PubChem CID:	92710046
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	419.097349
ΔH_f, kcal/mol:	-85.65
Dipole, Da:	1.73
IP(EA), eV:	-8.46(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-1,1-dioxothiolan-3-yl]-3,5-dimethyl-N-naphthalen-1-ylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)[C@H](CC2CCCCC2)N)OC

DOS

IR

Vibrations