Geometry & MOs

Info

ID:	129768
PubChem CID:	51073782
Reduced:	N3O3C16H29 (1)
Stoich.:	A3B3C16D29 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-156.06
Dipole, Da:	5.01
IP(EA), eV:	-8.78(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(azepan-1-yl)-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)N1CCN(CC1)C(C)C(=O)N2CCCCCC2

DOS

IR

Vibrations