Geometry & MOs

Info

ID:	362402
PubChem CID:	127307747
Reduced:	O2N5C19H21 (1)
Stoich.:	A2B5C19D21 (1)
Weight, g/mol:	288.169859
ΔH_f, kcal/mol:	13.56
Dipole, Da:	4.8
IP(EA), eV:	-9.04(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1H-imidazol-5-yl)-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)C3=NN(C4=CC=CC=C4C3=O)C

DOS

IR

Vibrations