Geometry & MOs

Info

ID:	270418
PubChem CID:	103636487
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	333.00259
ΔH_f, kcal/mol:	-73.24
Dipole, Da:	6.04
IP(EA), eV:	-9.19(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-2-iodophenyl)-(3-methylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(C1)C(=O)C2=CC(=O)N(C=C2)C

DOS

IR

Vibrations