Geometry & MOs

Info

ID:	206679
PubChem CID:	80282305
Reduced:	OSN3C15H19 (1)
Stoich.:	ABC3D15E19 (1)
Weight, g/mol:	263.236148
ΔH_f, kcal/mol:	-13.02
Dipole, Da:	4.84
IP(EA), eV:	-8.39(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N-(3-methylbutan-2-yl)-N'-[(6-methylpyridin-2-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NCCC2=NC(=CS2)C)NC

DOS

IR

Vibrations