Geometry & MOs

Info

ID:	223659
PubChem CID:	85335381
Reduced:	ClSN4O4C22H25 (1)
Stoich.:	ABC4D4E22F25 (1)
Weight, g/mol:	476.128504
ΔH_f, kcal/mol:	-112.88
Dipole, Da:	7.3
IP(EA), eV:	-9.39(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-chlorophenyl)sulfonyl-[[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methyl]amino]-4-methylpentanamide

Drug info:

PubChemData

Smile

CC(C)N(CC#N)C(=O)C(C)N1CCC(C1=O)NS(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

DOS

IR

Vibrations