Geometry & MOs

Info

ID:	364748
PubChem CID:	127316054
Reduced:	O2N5C20H31 (1)
Stoich.:	A2B5C20D31 (1)
Weight, g/mol:	387.263425
ΔH_f, kcal/mol:	-75.28
Dipole, Da:	5.29
IP(EA), eV:	-8.76(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[4-(1H-imidazol-2-ylmethyl)piperazine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)N2CCCC2)C(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations