Geometry & MOs

Info

ID:	363727
PubChem CID:	127313345
Reduced:	O2N5C20H33 (1)
Stoich.:	A2B5C20D33 (1)
Weight, g/mol:	378.263091
ΔH_f, kcal/mol:	-73.0
Dipole, Da:	6.57
IP(EA), eV:	-8.92(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-(2-oxoazocan-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C(C)(C)C)C(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations