Geometry & MOs

Info

ID:	60248
PubChem CID:	26675984
Reduced:	ON2H14C16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	366.132805
ΔH_f, kcal/mol:	77.87
Dipole, Da:	3.8
IP(EA), eV:	-9.05(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(Z)-(4-morpholin-4-yl-3-nitrophenyl)methylideneamino]oxymethyl]benzonitrile

Drug info:

PubChemData

Smile

CC1=CC=CC=C1/C=N\OCC2=CC=CC=C2C#N

DOS

IR

Vibrations