Geometry & MOs

Info

ID:	201437
PubChem CID:	79540986
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	271.157229
ΔH_f, kcal/mol:	-27.48
Dipole, Da:	1.83
IP(EA), eV:	-9.74(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1-phenylcyclopropanecarbonyl)pyrrolidin-2-yl]propan-2-one

Drug info:

PubChemData

Smile

CC(=O)CC1CCCN1C(=O)C2=NC=C(C=C2)C#N

DOS

IR

Vibrations