Geometry & MOs

Info

ID:	357198
PubChem CID:	127293702
Reduced:	S2N3O3C17H27 (1)
Stoich.:	A2B3C3D17E27 (1)
Weight, g/mol:	395.148121
ΔH_f, kcal/mol:	-116.73
Dipole, Da:	6.1
IP(EA), eV:	-8.98(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,7-dimethyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)S(=O)(=O)C2=CC=C(S2)C(=O)NC3CCN(CC3)C

DOS

IR

Vibrations