Geometry & MOs

Info

ID:	357429
PubChem CID:	127294062
Reduced:	N3O5C20H27 (1)
Stoich.:	A3B5C20D27 (1)
Weight, g/mol:	373.163771
ΔH_f, kcal/mol:	-184.65
Dipole, Da:	2.09
IP(EA), eV:	-8.41(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-N-(2-oxoazepan-3-yl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1CCN(C1=O)C2=CC3=C(C=C2)OCCO3)N4CCOCC4

DOS

IR

Vibrations