Geometry & MOs

Info

ID:	81258
PubChem CID:	49854518
Reduced:	N6O6C25H28 (1)
Stoich.:	A6B6C25D28 (1)
Weight, g/mol:	286.204513
ΔH_f, kcal/mol:	-139.4
Dipole, Da:	1.95
IP(EA), eV:	-9.12(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(3-propyl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]morpholine

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC2=C(C1C)C(=NC(=O)N2C3=C(ON=C3C)C)NNC(=O)C4=CC=C(C=C4)OC)C

DOS

IR

Vibrations