Geometry & MOs

Info

ID:	350827
PubChem CID:	127279115
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	352.15537
ΔH_f, kcal/mol:	-101.27
Dipole, Da:	9.88
IP(EA), eV:	-9.34(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2,4-dimethoxyphenyl)-2-(2-cyclobutylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)CN2CCCC2C3CCC3)C4CCS(=O)(=O)C4

DOS

IR

Vibrations