Geometry & MOs

Info

ID:	218575
PubChem CID:	85089637
Reduced:	N5O7C22H37 (1)
Stoich.:	A5B7C22D37 (1)
Weight, g/mol:	481.200156
ΔH_f, kcal/mol:	-289.76
Dipole, Da:	5.71
IP(EA), eV:	-9.89(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[4-(3-cyanophenoxy)-3-cyclopentyloxyphenyl]-2-oxopyrrolidin-1-yl]benzamide

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2C(C(C(O2)COC(=O)CCCCCCCCCCCN=[N+]=[N-])O)O

DOS

IR

Vibrations