Geometry & MOs

Info

ID:	305695
PubChem CID:	124965874
Reduced:	ON6C17H20 (1)
Stoich.:	AB6C17D20 (1)
Weight, g/mol:	342.169191
ΔH_f, kcal/mol:	55.16
Dipole, Da:	6.85
IP(EA), eV:	-9.44(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-4-acetyl-2-(2-methoxyphenyl)piperazin-1-yl]-2-imidazol-1-ylethanone

Drug info:

PubChemData

Smile

CC1=CC(=NC2=CC=NN12)[C@H]3CCCCN3C(=O)CN4C=CN=C4

DOS

IR

Vibrations