Geometry & MOs

Info

ID:	213737
PubChem CID:	81064828
Reduced:	O2N5C14H27 (1)
Stoich.:	A2B5C14D27 (1)
Weight, g/mol:	296.184841
ΔH_f, kcal/mol:	-71.32
Dipole, Da:	2.67
IP(EA), eV:	-9.07(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-3-nitro-2-N-(2-propan-2-yloxyethyl)-6-N-propylpyridine-2,6-diamine

Drug info:

PubChemData

Smile

CCCOC1=NC(=NC(=N1)N(C)CCOC(C)C)NCC

DOS

IR

Vibrations