Geometry & MOs

Info

ID:	364710
PubChem CID:	127316013
Reduced:	ON6C20H28 (1)
Stoich.:	AB6C20D28 (1)
Weight, g/mol:	366.241962
ΔH_f, kcal/mol:	12.08
Dipole, Da:	4.9
IP(EA), eV:	-8.43(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]-2-(4-phenylcyclohexyl)ethanone

Drug info:

PubChemData

Smile

C1CCCN(CC1)C2=NC=C(C=C2)C(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations