Geometry & MOs

Info

ID:	167813
PubChem CID:	74882480
Reduced:	N2O5C14H16 (1)
Stoich.:	A2B5C14D16 (1)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	-207.8
Dipole, Da:	3.6
IP(EA), eV:	-9.41(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2-methylpent-2-enoylamino)benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC=C1NC(=O)C2CC(NC(=O)C2)O

DOS

IR

Vibrations