Geometry & MOs

Info

ID:	50667
PubChem CID:	12013238
Reduced:	N2O4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	270.100442
ΔH_f, kcal/mol:	32.96
Dipole, Da:	2.01
IP(EA), eV:	-9.04(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(1-methoxyindol-3-yl)-5,7-dihydro-4H-pyrano[3,4-c][1,2]oxazole

Drug info:

PubChemData

Smile

CON1C=C(C2=CC=CC=C21)C(C[N+](=O)[O-])OCCC#C

DOS

IR

Vibrations