Geometry & MOs

Info

ID:	359094
PubChem CID:	127297339
Reduced:	ON2C10H18 (2)
Stoich.:	AB2C10D18 (2)
Weight, g/mol:	350.268176
ΔH_f, kcal/mol:	-112.0
Dipole, Da:	4.36
IP(EA), eV:	-8.72(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(cyclobutylmethyl)acetamide

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(=O)CN2CCN(CC2)CC(=O)NCC3CCC3)C

DOS

IR

Vibrations