Geometry & MOs

Info

ID:	287731
PubChem CID:	104253153
Reduced:	ON3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	279.194677
ΔH_f, kcal/mol:	-49.15
Dipole, Da:	2.38
IP(EA), eV:	-9.09(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[[6-methyl-2-(oxan-2-ylmethyl)pyrimidin-4-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)CC2CCCCO2)CNCC(C)C

DOS

IR

Vibrations