Geometry & MOs

Info

ID:	364813
PubChem CID:	127316221
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	372.171689
ΔH_f, kcal/mol:	-44.73
Dipole, Da:	6.41
IP(EA), eV:	-8.97(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-chlorophenyl)cyclopentyl]-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CC2=CC=CC=C2)C(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations