Geometry & MOs

Info

ID:	245464
PubChem CID:	99445090
Reduced:	FN2O3H17C22 (1)
Stoich.:	AB2C3D17E22 (1)
Weight, g/mol:	394.132885
ΔH_f, kcal/mol:	-58.75
Dipole, Da:	5.08
IP(EA), eV:	-9.21(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-N-(furan-2-ylmethyl)-2-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide

Drug info:

PubChemData

Smile

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N(CC3=CC=CO3)C4=CC=CC=C4F

DOS

IR

Vibrations