Geometry & MOs

Info

ID:	371502
PubChem CID:	127346718
Reduced:	ON5C22H33 (1)
Stoich.:	AB5C22D33 (1)
Weight, g/mol:	335.166748
ΔH_f, kcal/mol:	-11.73
Dipole, Da:	5.82
IP(EA), eV:	-9.03(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)N3CCC(C3)CN4CCCC4

DOS

IR

Vibrations