Geometry & MOs

Info

ID:	445205
PubChem CID:	135264898
Reduced:	OSN4C33H48 (1)
Stoich.:	ABC4D33E48 (1)
Weight, g/mol:	563.068462
ΔH_f, kcal/mol:	-34.49
Dipole, Da:	4.01
IP(EA), eV:	-7.36(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(1,3-benzodioxol-5-yl)-2-[(2,6-dichlorophenyl)sulfonylcarbamoylamino]-N-methyl-4-phenylbutanamide

Drug info:

PubChemData

Smile

CCC1=C2C(=CC(=C1)N3CCCN(CC3)C(=O)C4CCCCCCCC4)SC5=CC(=CC(=C5N2)CC)N(C)C

DOS

IR

Vibrations