Geometry & MOs

Info

ID:	390504
PubChem CID:	134999458
Reduced:	NOSiC21H33 (1)
Stoich.:	ABCD21E33 (1)
Weight, g/mol:	278.105528
ΔH_f, kcal/mol:	-84.56
Dipole, Da:	1.99
IP(EA), eV:	-8.7(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6E)-6-[[(2E)-2-[1-(1-benzofuran-2-yl)ethylidene]hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)O[C@@H]\1C[C@@H]2CCCN2C/C1=C\C3=CC=CC=C3

DOS

IR

Vibrations