Geometry & MOs

Info

ID:	228347
PubChem CID:	87564041
Reduced:	O2N4H14C17 (1)
Stoich.:	A2B4C14D17 (1)
Weight, g/mol:	275.131014
ΔH_f, kcal/mol:	125.87
Dipole, Da:	2.87
IP(EA), eV:	-9.18(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,3-diphenyloxiran-2-yl)methyl]-1H-pyrrole

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)C#CC2=CC=C(C=C2)C3=CC=NC(N3O)NO

DOS

IR

Vibrations