Geometry & MOs

Info

ID:	347945
PubChem CID:	127273007
Reduced:	ON5C17H25 (1)
Stoich.:	AB5C17D25 (1)
Weight, g/mol:	378.299476
ΔH_f, kcal/mol:	0.54
Dipole, Da:	4.91
IP(EA), eV:	-8.31(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopentanecarbonylamino)-N-[2-(4-methylpiperazin-1-yl)propyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CC1=CN2C=CC=CC2=N1)N3CCN(CC3)C

DOS

IR

Vibrations