Geometry & MOs

Info

ID:	403087
PubChem CID:	135058680
Reduced:	O2N3H11C17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	311.105862
ΔH_f, kcal/mol:	65.61
Dipole, Da:	3.93
IP(EA), eV:	-8.93(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-benzofuran-2-yl)-1-pyrimidin-2-ylindole

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(N2C3=NC=CC=N3)C4=CC=C(O4)C=O

DOS

IR

Vibrations