Geometry & MOs

Info

ID:	50662
PubChem CID:	12013232
Reduced:	NO3C26H27 (1)
Stoich.:	AB3C26D27 (1)
Weight, g/mol:	321.172879
ΔH_f, kcal/mol:	-66.77
Dipole, Da:	3.41
IP(EA), eV:	-9.59(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(CC(=O)C1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations