Geometry & MOs

Info

ID:	210608
PubChem CID:	80829986
Reduced:	ON5C14H21 (1)
Stoich.:	AB5C14D21 (1)
Weight, g/mol:	194.116761
ΔH_f, kcal/mol:	0.99
Dipole, Da:	4.72
IP(EA), eV:	-8.13(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(oxan-3-yl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCCNC1=CN2C=CN=C2C(=N1)NC3CCCOC3

DOS

IR

Vibrations