Geometry & MOs

Info

ID:	363856
PubChem CID:	127313513
Reduced:	O2N5C18H29 (1)
Stoich.:	A2B5C18D29 (1)
Weight, g/mol:	391.225977
ΔH_f, kcal/mol:	-61.27
Dipole, Da:	3.41
IP(EA), eV:	-8.74(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-1,2-dihydroacenaphthylene-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC(=O)NCCN2CCN(CC2)C(=O)C3CCC3)C

DOS

IR

Vibrations