Geometry & MOs

Info

ID:	433455
PubChem CID:	135173592
Reduced:	NO2C11H19 (1)
Stoich.:	AB2C11D19 (1)
Weight, g/mol:	442.156243
ΔH_f, kcal/mol:	-98.11
Dipole, Da:	3.25
IP(EA), eV:	-9.44(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-4-[[6-(1,3-dihydroisoindol-2-ylmethyl)-4-oxopyran-3-yl]oxymethyl]cyclopent-2-en-1-yl]cyclopropanesulfonamide

Drug info:

PubChemData

Smile

C1CN(C1)C(=O)C2CCC(CC2)CO

DOS

IR

Vibrations