Geometry & MOs

Info

ID:	404576
PubChem CID:	135066859
Reduced:	NO3H13C17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-15.07
Dipole, Da:	4.2
IP(EA), eV:	-9.33(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(E)-N-methoxy-C-methylcarbonimidoyl]phenyl] 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC=C1C2=NOC(=C2)C3=CC=CC=C3

DOS

IR

Vibrations