Geometry & MOs

Info

ID:	350831
PubChem CID:	127279119
Reduced:	ClN2O3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	317.12949
ΔH_f, kcal/mol:	-108.85
Dipole, Da:	0.69
IP(EA), eV:	-8.43(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-cyanophenyl)-2-(2-cyclobutylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(C1)C2CCCN2CC(=O)NC3=CC4=C(C=C3Cl)OCCCO4

DOS

IR

Vibrations