Geometry & MOs

Info

ID:	199147
PubChem CID:	79204633
Reduced:	N2O3C16H22 (1)
Stoich.:	A2B3C16D22 (1)
Weight, g/mol:	295.225977
ΔH_f, kcal/mol:	-131.67
Dipole, Da:	3.19
IP(EA), eV:	-8.78(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethyl)-3-[2-(2-methoxypropan-2-yl)-4,6-dimethylpyrimidin-5-yl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)N(C(=N2)CCC(C)O)CCC(=O)O

DOS

IR

Vibrations