Geometry & MOs

Info

ID:	55001
PubChem CID:	17389644
Reduced:	ClNC8H18 (1)
Stoich.:	ABC8D18 (1)
Weight, g/mol:	308.173607
ΔH_f, kcal/mol:	-60.02
Dipole, Da:	0.87
IP(EA), eV:	-8.62(2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(azepan-2-yl)-N,N-dimethylaniline;oxalic acid

Drug info:

PubChemData

Smile

CC(C)C1CCCCN1.Cl

DOS

IR

Vibrations