Geometry & MOs

Info

ID:	363874
PubChem CID:	127313531
Reduced:	O2N3C21H29 (1)
Stoich.:	A2B3C21D29 (1)
Weight, g/mol:	383.257277
ΔH_f, kcal/mol:	-45.42
Dipole, Da:	6.53
IP(EA), eV:	-8.66(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)C3(CC3)C4=CC=CC=C4

DOS

IR

Vibrations