Geometry & MOs

Info

ID:	75820
PubChem CID:	48424022
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	305.179107
ΔH_f, kcal/mol:	-136.35
Dipole, Da:	5.46
IP(EA), eV:	-8.78(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[2-[(3-fluorophenyl)methyl]pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC(=C1)COCCOC)OCC2CC2

DOS

IR

Vibrations