Geometry & MOs

Info

ID:	210165
PubChem CID:	80769173
Reduced:	N2C6H11 (2)
Stoich.:	A2B6C11 (2)
Weight, g/mol:	194.153147
ΔH_f, kcal/mol:	-8.9
Dipole, Da:	1.72
IP(EA), eV:	-8.46(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-4-N-(2-methylbutan-2-yl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCC(C)(C)NC1=NC(=NC(=C1)C)NCC

DOS

IR

Vibrations