Geometry & MOs

Info

ID:	355553
PubChem CID:	127289311
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-33.28
Dipole, Da:	2.08
IP(EA), eV:	-8.9(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)C3CCCN3C(=O)CC4=CC=CC=C4

DOS

IR

Vibrations