Geometry & MOs

Info

ID:	210436
PubChem CID:	80807581
Reduced:	N5C14H27 (1)
Stoich.:	A5B14C27 (1)
Weight, g/mol:	265.226646
ΔH_f, kcal/mol:	-0.38
Dipole, Da:	4.62
IP(EA), eV:	-8.59(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1NC(CC(C)C)CN(C)C)N

DOS

IR

Vibrations