Geometry & MOs

Info

ID:	364737
PubChem CID:	127316043
Reduced:	ON4C19H24 (1)
Stoich.:	AB4C19D24 (1)
Weight, g/mol:	390.216809
ΔH_f, kcal/mol:	-3.3
Dipole, Da:	6.16
IP(EA), eV:	-9.0(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]-[1-(2-methylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanone

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)CC(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations