Geometry & MOs

Info

ID:	391565
PubChem CID:	135006565
Reduced:	NSO2C20H21 (1)
Stoich.:	ABC2D20E21 (1)
Weight, g/mol:	295.173487
ΔH_f, kcal/mol:	-12.88
Dipole, Da:	5.81
IP(EA), eV:	-8.57(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-N-[(2R)-2-diethylphosphoryl-3-methylbutan-2-yl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C=C[C@@]3(C[C@@H]3[C@H]2C4=CC=CC=C4)C

DOS

IR

Vibrations