Geometry & MOs

Info

ID:	136279
PubChem CID:	52011287
Reduced:	N2O5C20H20 (1)
Stoich.:	A2B5C20D20 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-160.73
Dipole, Da:	3.42
IP(EA), eV:	-8.82(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[2-(4-methoxyphenyl)ethyl]-2,4,6-trimethyl-3-oxo-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)O[C@@](C(=O)N2C)(C)C(=O)NC3=CC=CC(=C3)C(=O)OC

DOS

IR

Vibrations