Geometry & MOs

Info

ID:	206700
PubChem CID:	80286988
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	235.204848
ΔH_f, kcal/mol:	-49.73
Dipole, Da:	4.9
IP(EA), eV:	-8.93(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-4-N-[(6-methylpyridin-2-yl)methyl]pentane-1,4-diamine

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CN(C)CC2(CCCCCC2)CO

DOS

IR

Vibrations