Geometry & MOs

Info

ID:	177772
PubChem CID:	76229104
Reduced:	O2N3C11H17 (2)
Stoich.:	A2B3C11D17 (2)
Weight, g/mol:	447.194026
ΔH_f, kcal/mol:	-180.06
Dipole, Da:	7.5
IP(EA), eV:	-8.98(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-1,3-diazinan-5-yl]-N-(2-methylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide

Drug info:

PubChemData

Smile

CC(C)CN1C(C(C(=O)NC1=O)N(CC(C)C)C(=O)CCNC(=O)NC2=CC=CC=C2)N

DOS

IR

Vibrations