Geometry & MOs

Info

ID:	279586
PubChem CID:	103844394
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-119.78
Dipole, Da:	4.09
IP(EA), eV:	-9.17(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[[(4-methoxypyrimidin-2-yl)amino]methyl]butan-1-ol

Drug info:

PubChemData

Smile

CCC(CC)(CNC1=CC(=NC=C1)C(=O)OC)CO

DOS

IR

Vibrations