Geometry & MOs

Info

ID:	174475
PubChem CID:	75768456
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	314.13789
ΔH_f, kcal/mol:	-96.09
Dipole, Da:	5.27
IP(EA), eV:	-8.56(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpyrazol-3-yl)-2,6-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(C(=O)N2)(C)C(=O)NC3=CC(=C(C=C3)C)C

DOS

IR

Vibrations