Geometry & MOs

Info

ID:	283002
PubChem CID:	103952538
Reduced:	ON4C10H10 (1)
Stoich.:	AB4C10D10 (1)
Weight, g/mol:	222.148061
ΔH_f, kcal/mol:	18.25
Dipole, Da:	4.6
IP(EA), eV:	-9.45(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[3-(cyclopropylmethoxy)propyl]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

C1C(CNC1=O)NC2=C(C=CC=N2)C#N

DOS

IR

Vibrations