Geometry & MOs

Info

ID:	66265
PubChem CID:	46501234
Reduced:	NOC13H19 (2)
Stoich.:	ABC13D19 (2)
Weight, g/mol:	583.11067
ΔH_f, kcal/mol:	-66.31
Dipole, Da:	4.69
IP(EA), eV:	-8.61(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-3-[(2Z)-2-[[2-[(3-bromophenyl)methoxy]phenyl]methylidene]hydrazinyl]-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1CC(=CCC1/C=N/NC(=O)COC2=C(C=CC(=C2)C)C(C)C)CCC=C(C)C

DOS

IR

Vibrations