Geometry & MOs

Info

ID:	319611
PubChem CID:	126656795
Reduced:	NC10H11 (1)
Stoich.:	AB10C11 (1)
Weight, g/mol:	383.173273
ΔH_f, kcal/mol:	52.43
Dipole, Da:	0.37
IP(EA), eV:	-8.15(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3S)-1-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]-2-oxopyrrolidin-3-yl]oxybenzaldehyde

Drug info:

PubChemData

Smile

C=CC1=CC=CC=C1NC=C

DOS

IR

Vibrations