Geometry & MOs

Info

ID:	355567
PubChem CID:	127289325
Reduced:	OSN8C14H22 (1)
Stoich.:	ABC8D14E22 (1)
Weight, g/mol:	361.247775
ΔH_f, kcal/mol:	65.92
Dipole, Da:	8.61
IP(EA), eV:	-9.13(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)C(=O)CCSC3=NN=NN3C

DOS

IR

Vibrations