Geometry & MOs

Info

ID:	445981
PubChem CID:	135270999
Reduced:	N2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	194.153147
ΔH_f, kcal/mol:	45.93
Dipole, Da:	2.72
IP(EA), eV:	-9.83(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-butyl-5,6-dimethylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCCC#CC1=NC(=NC(=C1)C)C

DOS

IR

Vibrations