Geometry & MOs

Info

ID:	196430
PubChem CID:	78824723
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	410.231791
ΔH_f, kcal/mol:	-136.39
Dipole, Da:	6.56
IP(EA), eV:	-9.49(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)piperazin-1-yl]-2-(4-methoxyphenyl)acetonitrile

Drug info:

PubChemData

Smile

COCCCNC(=O)C1=CC=C(O1)COC

DOS

IR

Vibrations