Geometry & MOs

Info

ID:	210435
PubChem CID:	80807580
Reduced:	N5C15H27 (1)
Stoich.:	A5B15C27 (1)
Weight, g/mol:	265.226646
ΔH_f, kcal/mol:	-2.75
Dipole, Da:	2.13
IP(EA), eV:	-8.73(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[1-(dimethylamino)-4-methylpentan-2-yl]-5-ethylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)NC2=NC(=NC(=C2)C)NCC

DOS

IR

Vibrations