Geometry & MOs

Info

ID:	128840
PubChem CID:	51060323
Reduced:	N3O6H25C26 (1)
Stoich.:	A3B6C25D26 (1)
Weight, g/mol:	495.119713
ΔH_f, kcal/mol:	-134.29
Dipole, Da:	2.95
IP(EA), eV:	-8.56(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(E)-[[2-[(3-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=N/NC(=O)C(=O)NC2=CC=CC(=C2)C)OC(=O)C3=CC=C(C=C3)OC

DOS

IR

Vibrations