Geometry & MOs

Info

ID:	350829
PubChem CID:	127279117
Reduced:	ClN2O3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	382.229014
ΔH_f, kcal/mol:	-111.43
Dipole, Da:	5.74
IP(EA), eV:	-8.1(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclobutylpyrrolidin-1-yl)-N-cyclohexyl-N-(1,1-dioxothiolan-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1NC(=O)CN2CCCC2C3CCC3)OC)Cl

DOS

IR

Vibrations