Geometry & MOs

Info

ID:	390318
PubChem CID:	134998458
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	350.199428
ΔH_f, kcal/mol:	-9.81
Dipole, Da:	1.78
IP(EA), eV:	-9.49(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1[C@@H]2[C@@H](CO1)NO[C@@H]2C3=CC=CC=C3

DOS

IR

Vibrations