Geometry & MOs

Info

ID:	366506
PubChem CID:	127320022
Reduced:	SN4O4C17H30 (1)
Stoich.:	AB4C4D17E30 (1)
Weight, g/mol:	295.225977
ΔH_f, kcal/mol:	-173.36
Dipole, Da:	2.34
IP(EA), eV:	-8.92(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetylpiperidin-4-yl)-2-(azepan-1-yl)propanamide

Drug info:

PubChemData

Smile

CN(C)CCN1CC(CC1=O)C(=O)N2CCN(CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations