Geometry & MOs

Info

ID:	401994
PubChem CID:	135053745
Reduced:	ClO2N3H8C14 (1)
Stoich.:	AB2C3D8E14 (1)
Weight, g/mol:	376.174693
ΔH_f, kcal/mol:	84.54
Dipole, Da:	8.27
IP(EA), eV:	-9.84(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(Z)-2-(4-methoxyphenyl)-2-phenylethenyl]-2,4-diaza-3-boratricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(N=N2)C3=CC(=CC=C3)[N+](=O)[O-])Cl

DOS

IR

Vibrations