Geometry & MOs

Info

ID:	16842
PubChem CID:	477480
Reduced:	SN3O4H17C21 (1)
Stoich.:	AB3C4D17E21 (1)
Weight, g/mol:	407.093977
ΔH_f, kcal/mol:	-53.44
Dipole, Da:	3.91
IP(EA), eV:	-8.97(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(hydroxyamino)-N-[3-[(5-methyl-4-oxothieno[2,3-d][1,3]oxazin-2-yl)methyl]phenyl]benzamide

Drug info:

PubChemData

Smile

CC1=CSC2=C1C(=O)OC(=N2)CC3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)NO

DOS

IR

Vibrations