Geometry & MOs

Info

ID:	35047
PubChem CID:	7979231
Reduced:	SN2O4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	417.172228
ΔH_f, kcal/mol:	-135.11
Dipole, Da:	5.99
IP(EA), eV:	-9.51(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[(2S)-4-methyl-1-[2-(4-methylbenzoyl)hydrazinyl]-1-oxopentan-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CC1)OC(=O)[C@@H]2CS[C@@]3(N2C(=O)CC3)C4=CC=CC=C4

DOS

IR

Vibrations