Geometry & MOs

Info

ID:	197149
PubChem CID:	78929162
Reduced:	N2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	261.055656
ΔH_f, kcal/mol:	-49.61
Dipole, Da:	4.01
IP(EA), eV:	-9.18(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-chlorophenyl)methoxy]-6-methylpyridine-2-carbaldehyde

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)OCC2=NC(=C(O2)C)C)C=O

DOS

IR

Vibrations