Geometry & MOs

Info

ID:	210734
PubChem CID:	80849056
Reduced:	ON6C10H20 (1)
Stoich.:	AB6C10D20 (1)
Weight, g/mol:	250.215747
ΔH_f, kcal/mol:	-19.91
Dipole, Da:	1.35
IP(EA), eV:	-8.98(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-4-N-(2-methylpropyl)-4-N-pentan-3-ylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC(C)C(CO)NC1=NC(=NC(=N1)N)N(C)C

DOS

IR

Vibrations