Geometry & MOs

Info

ID:	55003
PubChem CID:	17389646
Reduced:	NO4C11H21 (1)
Stoich.:	AB4C11D21 (1)
Weight, g/mol:	246.157957
ΔH_f, kcal/mol:	-191.66
Dipole, Da:	1.64
IP(EA), eV:	-8.64(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(azepan-2-yl)-N,N-dimethylmethanamine;oxalic acid

Drug info:

PubChemData

Smile

CC(C)C1CCCCCN1.C(=O)(C(=O)O)O

DOS

IR

Vibrations