Geometry & MOs

Info

ID:	45226
PubChem CID:	10509695
Reduced:	NO2H23C27 (1)
Stoich.:	AB2C23D27 (1)
Weight, g/mol:	834.115698
ΔH_f, kcal/mol:	30.31
Dipole, Da:	5.16
IP(EA), eV:	-8.34(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](C(C2=CC=CC=C2)(C3=CC=CC=C3)O)N/C=C\4/C=CC=CC4=O

DOS

IR

Vibrations