Geometry & MOs

Info

ID:	55252
PubChem CID:	17389962
Reduced:	N2O4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	210.209599
ΔH_f, kcal/mol:	-211.71
Dipole, Da:	11.16
IP(EA), eV:	-8.99(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methylpiperidin-1-yl)methyl]azepane

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2CCCCCN2.C(=O)(C(=O)O)O

DOS

IR

Vibrations