Geometry & MOs

Info

ID:	175650
PubChem CID:	75930783
Reduced:	SO2N6H22C23 (1)
Stoich.:	AB2C6D22E23 (1)
Weight, g/mol:	447.215806
ΔH_f, kcal/mol:	38.77
Dipole, Da:	4.6
IP(EA), eV:	-8.75(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopropanecarbonyl)-N-[5-oxo-1-(4-phenoxyphenyl)pyrrolidin-3-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1C(N(CS1)C(=O)C2=CNC3=CC=CC=C32)C(=O)NC4=NN(C=C4)CCC5=CC=NC=C5

DOS

IR

Vibrations