Geometry & MOs

Info

ID:	244982
PubChem CID:	99431927
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	425.158685
ΔH_f, kcal/mol:	-147.31
Dipole, Da:	4.82
IP(EA), eV:	-9.03(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[2-oxo-2-[4-(3-oxo-4H-1,4-benzoxazine-6-carbonyl)piperidin-1-yl]ethyl]furan-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CC(=O)N1CCC(CC1)C(=O)C2=CC3=C(C=C2)OCC(=O)N3

DOS

IR

Vibrations