Geometry & MOs

Info

ID:	210782
PubChem CID:	80854884
Reduced:	NC4H7 (4)
Stoich.:	AB4C7 (4)
Weight, g/mol:	264.195011
ΔH_f, kcal/mol:	-3.48
Dipole, Da:	4.17
IP(EA), eV:	-8.37(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-5-propan-2-ylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=C(C(=NC=N1)N2CCC(C2)(CC)CC)C

DOS

IR

Vibrations