Geometry & MOs

Info

ID:	317986
PubChem CID:	126648215
Reduced:	ClFOSN3H11C12 (1)
Stoich.:	ABCDE3F11G12 (1)
Weight, g/mol:	314.126657
ΔH_f, kcal/mol:	-13.84
Dipole, Da:	4.31
IP(EA), eV:	-8.7(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-4-[(4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-6-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Cl)N(CCC2=C(C=CO2)F)C(=S)N

DOS

IR

Vibrations