Geometry & MOs

Info

ID:	391164
PubChem CID:	135003265
Reduced:	NO2C22H23 (1)
Stoich.:	AB2C22D23 (1)
Weight, g/mol:	189.091555
ΔH_f, kcal/mol:	8.09
Dipole, Da:	2.58
IP(EA), eV:	-8.86(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CN1[C@H]([C@@H](C2=C([C@@H]3[C@H]2OCC3)C4=CC=CC=C41)OC)C5=CC=CC=C5

DOS

IR

Vibrations