Geometry & MOs

Info

ID:	353135
PubChem CID:	127284315
Reduced:	N3O4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	397.146013
ΔH_f, kcal/mol:	-146.92
Dipole, Da:	4.79
IP(EA), eV:	-9.2(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2-methyl-4-thiomorpholin-4-ylphenyl)-3-oxo-4H-1,4-benzoxazine-8-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NC2=CC=CC(=C2O1)C(=O)NC3CCCNC3=O

DOS

IR

Vibrations