Geometry & MOs

Info

ID:	29014
PubChem CID:	831123
Reduced:	ClN2O3H13C16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	340.178693
ΔH_f, kcal/mol:	-48.97
Dipole, Da:	0.99
IP(EA), eV:	-9.48(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)methylideneamino]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C=NNC(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations