Geometry & MOs

Info

ID:	29901
PubChem CID:	838064
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-47.74
Dipole, Da:	6.9
IP(EA), eV:	-9.1(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[(2R)-2-methylbutanoyl]amino]benzoate

Drug info:

PubChemData

Smile

CC[C@H](C)C(=O)NC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations