Geometry & MOs

Info

ID:	58214
PubChem CID:	24434790
Reduced:	O3N4H16C19 (1)
Stoich.:	A3B4C16D19 (1)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	17.6
Dipole, Da:	4.9
IP(EA), eV:	-8.65(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]pyridin-2-amine

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=N/NC2=CC=CC=N2)OC(=O)C3=CN=CC=C3

DOS

IR

Vibrations