Geometry & MOs

Info

ID:	364790
PubChem CID:	127316128
Reduced:	FO2N5C19H22 (1)
Stoich.:	AB2C5D19E22 (1)
Weight, g/mol:	372.171689
ΔH_f, kcal/mol:	-70.68
Dipole, Da:	5.82
IP(EA), eV:	-8.97(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=NC=CN2)C(=O)C3CC(=O)N(C3)C4=CC=CC=C4F

DOS

IR

Vibrations