Geometry & MOs

Info

ID:	136320
PubChem CID:	52018853
Reduced:	FOSCl2N2H13C20 (1)
Stoich.:	ABCD2E2F13G20 (1)
Weight, g/mol:	386.163043
ΔH_f, kcal/mol:	-7.58
Dipole, Da:	1.77
IP(EA), eV:	-8.74(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[(2R)-6-methyl-3-oxo-4H-1,4-benzoxazin-2-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)CN2C3=C(C=C2C(=O)NC4=C(C=C(C=C4)Cl)Cl)SC=C3

DOS

IR

Vibrations