Geometry & MOs

Info

ID:	137140
PubChem CID:	52157988
Reduced:	N2O5C15H18 (1)
Stoich.:	A2B5C15D18 (1)
Weight, g/mol:	307.095691
ΔH_f, kcal/mol:	-200.22
Dipole, Da:	6.14
IP(EA), eV:	-9.12(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-cyanophenyl)-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)O)NC(=O)[C@]1(C(=O)NC2=CC=CC=C2O1)C

DOS

IR

Vibrations