Geometry & MOs

Info

ID:	201438
PubChem CID:	79540987
Reduced:	NO2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	251.098
ΔH_f, kcal/mol:	-57.66
Dipole, Da:	3.26
IP(EA), eV:	-9.4(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-methylthiophene-2-carbonyl)pyrrolidin-2-yl]propan-2-one

Drug info:

PubChemData

Smile

CC(=O)CC1CCCN1C(=O)C2(CC2)C3=CC=CC=C3

DOS

IR

Vibrations