Geometry & MOs

Info

ID:	329770
PubChem CID:	127246637
Reduced:	N2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	40.83
Dipole, Da:	3.55
IP(EA), eV:	-8.38(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-1-yl]methyl]-5-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2CCN(C2)CC3=CC=CN3C)C

DOS

IR

Vibrations