Geometry & MOs

Info

ID:	187592
PubChem CID:	77595340
Reduced:	O4N9C34H45 (1)
Stoich.:	A4B9C34D45 (1)
Weight, g/mol:	329.059603
ΔH_f, kcal/mol:	-88.15
Dipole, Da:	2.41
IP(EA), eV:	-7.94(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C4=NC(=NC(=N4)N5C(CCC5CO)CO)N6CC7CCC(C6)O7

DOS

IR

Vibrations