Geometry & MOs

Info

ID:	210200
PubChem CID:	80773860
Reduced:	N4C17H30 (1)
Stoich.:	A4B17C30 (1)
Weight, g/mol:	253.153875
ΔH_f, kcal/mol:	-3.45
Dipole, Da:	2.55
IP(EA), eV:	-8.66(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N,6-N-diethyl-5-nitro-4-N-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=C(C(=NC=N1)N(C)C2CCCCCC2)CC

DOS

IR

Vibrations