Geometry & MOs

Info

ID:	354945
PubChem CID:	127287806
Reduced:	N2O3C11H18 (1)
Stoich.:	A2B3C11D18 (1)
Weight, g/mol:	387.141676
ΔH_f, kcal/mol:	-141.84
Dipole, Da:	6.02
IP(EA), eV:	-9.65(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[4-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CCC1CN(CCO1)C(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations