Geometry & MOs

Info

ID:	296578
PubChem CID:	117584938
Reduced:	N5C13H23 (1)
Stoich.:	A5B13C23 (1)
Weight, g/mol:	262.10659
ΔH_f, kcal/mol:	31.43
Dipole, Da:	4.51
IP(EA), eV:	-8.53(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-[methyl-(5-methylfuran-2-yl)amino]pyrimidin-4-yl]amino]acetic acid

Drug info:

PubChemData

Smile

CN(CCCN)C1=NC=NC(=C1)NCC2CCC2

DOS

IR

Vibrations