Geometry & MOs

Info

ID:	311931
PubChem CID:	126599410
Reduced:	O2N4C5H10 (1)
Stoich.:	A2B4C5D10 (1)
Weight, g/mol:	467.217738
ΔH_f, kcal/mol:	50.63
Dipole, Da:	6.81
IP(EA), eV:	-10.27(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethenyl-5-(methylideneamino)-N'-[[5-[5-(2-pentyl-1H-imidazol-5-yl)thiophen-2-yl]thiophen-2-yl]methyl]pentanimidamide

Drug info:

PubChemData

Smile

CC1=NN=N[N+]1(CCCO)[O-]

DOS

IR

Vibrations