Geometry & MOs

Info

ID:	43599
PubChem CID:	10321523
Reduced:	N2O3H26C29 (1)
Stoich.:	A2B3C26D29 (1)
Weight, g/mol:	450.194343
ΔH_f, kcal/mol:	-32.44
Dipole, Da:	4.1
IP(EA), eV:	-8.15(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl)-3-methyl-4-oxo-2-phenylchromene-8-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=C6C7=C(CCC7)NC6=C5

DOS

IR

Vibrations