Geometry & MOs

Info

ID:	38109
PubChem CID:	8027102
Reduced:	N2O3H16C17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	182.141913
ΔH_f, kcal/mol:	-11.72
Dipole, Da:	3.53
IP(EA), eV:	-8.91(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-N-[(4aR,8aR)-1-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ylidene]hydroxylamine

Drug info:

PubChemData

Smile

C[C@](C1=CN=CC=C1)(C2=CC(=NO2)C3=CC=C(C=C3)OC)O

DOS

IR

Vibrations