Geometry & MOs

Info

ID:	351008
PubChem CID:	127279445
Reduced:	O3N4C19H28 (1)
Stoich.:	A3B4C19D28 (1)
Weight, g/mol:	395.148121
ΔH_f, kcal/mol:	-122.47
Dipole, Da:	6.87
IP(EA), eV:	-8.05(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)NCCN3CCOCC3(C)C

DOS

IR

Vibrations