Geometry & MOs

Info

ID:	128488
PubChem CID:	51046766
Reduced:	N3O3C23H27 (1)
Stoich.:	A3B3C23D27 (1)
Weight, g/mol:	356.153621
ΔH_f, kcal/mol:	-115.03
Dipole, Da:	0.99
IP(EA), eV:	-8.85(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(7-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)-N-(3-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CCC(C)N1C(=O)C2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=CC(=C3)C(C)C

DOS

IR

Vibrations