Geometry & MOs

Info

ID:	201435
PubChem CID:	79540984
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	-66.88
Dipole, Da:	5.87
IP(EA), eV:	-9.25(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C(=O)N2CCCC2CC(=O)C

DOS

IR

Vibrations