Geometry & MOs

Info

ID:	296130
PubChem CID:	117557351
Reduced:	ON4C10H16 (1)
Stoich.:	AB4C10D16 (1)
Weight, g/mol:	224.163711
ΔH_f, kcal/mol:	-8.23
Dipole, Da:	2.78
IP(EA), eV:	-8.99(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(butan-2-ylamino)-2-methylpyrimidin-4-yl]amino]ethanol

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)NCC=C)NCCO

DOS

IR

Vibrations