Geometry & MOs

Info

ID:	345657
PubChem CID:	127269957
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	371.257277
ΔH_f, kcal/mol:	-124.55
Dipole, Da:	0.64
IP(EA), eV:	-9.14(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(cycloheptanecarbonyl)piperazin-1-yl]-N-(2-ethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCN(CC1)C(=O)C2CCCCCC2

DOS

IR

Vibrations