Geometry & MOs

Info

ID:	136280
PubChem CID:	52011385
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-125.99
Dipole, Da:	4.66
IP(EA), eV:	-8.54(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(3-methoxyphenyl)methyl]-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)NCCC3=CC=C(C=C3)OC

DOS

IR

Vibrations