Geometry & MOs

Info

ID:	272432
PubChem CID:	103743004
Reduced:	ON3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	251.163377
ΔH_f, kcal/mol:	21.31
Dipole, Da:	2.2
IP(EA), eV:	-8.78(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-6-methyl-N-[(4-methyloxan-4-yl)methyl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1(CCOCC1)CNC2=NC3=CC=CC=C3C(=C2)C#N

DOS

IR

Vibrations