Geometry & MOs

Info

ID:	281016
PubChem CID:	103852419
Reduced:	N2O4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	262.095357
ΔH_f, kcal/mol:	-60.02
Dipole, Da:	7.15
IP(EA), eV:	-9.85(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-hydroxy-3-nitrophenyl)-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CCN(CC1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O

DOS

IR

Vibrations