Geometry & MOs

Info

ID:	353758
PubChem CID:	127285335
Reduced:	O3N4C18H30 (1)
Stoich.:	A3B4C18D30 (1)
Weight, g/mol:	386.177647
ΔH_f, kcal/mol:	-148.84
Dipole, Da:	4.97
IP(EA), eV:	-9.09(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-[4-(2-oxopyrrolidin-1-yl)piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)C(=O)C)N2CCC(CC2)N3CCCC3=O

DOS

IR

Vibrations