Geometry & MOs

Info

ID:	218497
PubChem CID:	85089536
Reduced:	NO5C29H31 (1)
Stoich.:	AB5C29D31 (1)
Weight, g/mol:	473.198442
ΔH_f, kcal/mol:	-125.22
Dipole, Da:	5.61
IP(EA), eV:	-9.07(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-(dimethylsulfamoyl)-1,3-benzodioxol-5-yl]-N-methyl-N-(1-phenyl-2-pyrrolidin-1-ylethyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)CCCCC=C(C1=CC=C(C=C1)OCCOC2=CC=CC(=C2)C=O)C3=CN=CC=C3

DOS

IR

Vibrations