Geometry & MOs

Info

ID:	205759
PubChem CID:	80153473
Reduced:	NO3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	269.189198
ΔH_f, kcal/mol:	-87.8
Dipole, Da:	5.88
IP(EA), eV:	-9.21(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[[5-(ethylaminomethyl)pyridin-2-yl]methyl]aniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)OCC2=NC=C(C=C2)C(=O)O)C

DOS

IR

Vibrations