Geometry & MOs

Info

ID:	355927
PubChem CID:	127290779
Reduced:	ON7C14H21 (1)
Stoich.:	AB7C14D21 (1)
Weight, g/mol:	395.232125
ΔH_f, kcal/mol:	44.87
Dipole, Da:	5.12
IP(EA), eV:	-9.14(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(1-methylimidazol-2-yl)methyl]piperazine-1-carbonyl]-1-(1-phenylethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)CCN3C=CN=N3

DOS

IR

Vibrations