Geometry & MOs

Info

ID:	279603
PubChem CID:	103844441
Reduced:	O3N4C14H26 (1)
Stoich.:	A3B4C14D26 (1)
Weight, g/mol:	224.163711
ΔH_f, kcal/mol:	-149.5
Dipole, Da:	6.34
IP(EA), eV:	-8.85(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3-aminopyrazin-2-yl)amino]methyl]-2-ethylbutan-1-ol

Drug info:

PubChemData

Smile

CCCN1C(=C(C(=O)NC1=O)NCC(CC)(CC)CO)N

DOS

IR

Vibrations