Geometry & MOs

Info

ID:	206600
PubChem CID:	80270896
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	249.220498
ΔH_f, kcal/mol:	-80.26
Dipole, Da:	2.22
IP(EA), eV:	-9.62(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-ethyl-2,3-dimethyl-2-N-[(6-methylpyridin-2-yl)methyl]butane-1,2-diamine

Drug info:

PubChemData

Smile

CCC1(CCCC1)C2=C(N=CO2)CO

DOS

IR

Vibrations