Geometry & MOs

Info

ID:	28938
PubChem CID:	830798
Reduced:	NOC8H9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	316.097855
ΔH_f, kcal/mol:	-48.83
Dipole, Da:	7.53
IP(EA), eV:	-8.86(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methylideneamino]-3-(2-methylphenoxy)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(C(=C(N1)C)C(=O)C)C2=CN=CC=C2)C(=O)C

DOS

IR

Vibrations