Geometry & MOs

Info

ID:	210105
PubChem CID:	80763363
Reduced:	N5C15H21 (1)
Stoich.:	A5B15C21 (1)
Weight, g/mol:	228.137497
ΔH_f, kcal/mol:	29.56
Dipole, Da:	2.24
IP(EA), eV:	-8.27(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2,5-dimethylphenyl)-5-methylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC(=N1)N)NC2=C(C=CC(=C2)C)C

DOS

IR

Vibrations