Geometry & MOs

Info

ID:	364789
PubChem CID:	127316127
Reduced:	ON8C16H20 (1)
Stoich.:	AB8C16D20 (1)
Weight, g/mol:	371.175753
ΔH_f, kcal/mol:	71.21
Dipole, Da:	7.24
IP(EA), eV:	-9.16(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-4-[4-(1H-imidazol-2-ylmethyl)piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=NC2=NC(=NN12)C(=O)N3CCN(CC3)CC4=NC=CN4)C

DOS

IR

Vibrations